PhytoHub: Showing entry for Apigenin

Apigenin

Identification

PhytoHub ID

PHUB000861

Name

Apigenin

Systematic Name

Not Available

Synonyms

5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
5,7,4'-Trihydroxyflavone
chamomile
versulin

CAS Number

520-36-5

Average Mass

270.24

Monoisotopic Mass

270.052823422

Chemical Formula

C₁₅H₁₀O₅

IUPAC Name

5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

InChI Key

KZNIFHPLKGYRTM-UHFFFAOYSA-N

InChI Identifier

InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H

SMILES

OC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(O)C=C2O1

Structure

Similar Structures

Calculated Properties

Solubility (ALOGPS): 1.18e-01 g/l
LogS (ALOGPS): -3.36
LogP (ALOGPS): 3.07
Hydrogen Acceptors: 5
Hydrogen Donors: 3
Rotatable Bond Count: 1
Polar Surface Area: 86.99000000000001
Refractivity: 72.91390000000001
Polarizability: 26.7801790574094
Formal Charge: 0
Physiological Charge: -1
pKa (strongest basic): -5.381179969028222
pKa (strongest acidic): 6.574691761170129
Number of Rings: 3
Rule of Five: Yes
Bioavailability: Yes
Ghose Filter: Yes
Veber's Rule: No
MDDR-like Rule: No

Taxonomy as Food Phytochemical

Family: Polyphenols
Class: Flavonoids
Sub-class: Flavones

Taxonomy as Metabolite

Metabolite Family: (Poly)phenol metabolites
Metabolite Class: Flavonoid metabolites
Metabolite Sub-class: Flavones (parent and host metabolites)

Taxonomy of its Food Phytochemical Precursor(s)

Food Phytochemical	Family	Class	Sub-class
Apigenin	Polyphenols	Flavonoids	Flavones	Show Food Phytochemical
Apigenin 7-O-glucoside	Polyphenols	Flavonoids	Flavones	Show Food Phytochemical
Apigenin 7-O-rutinoside	Polyphenols	Flavonoids	Flavones	Show Food Phytochemical

Classyfire Taxonomy

Kingdom Name: Organic compounds
Class: Flavonoids
Super-class: Phenylpropanoids and polyketides
Sub-class: Flavones
Direct Parent Name: Flavones
Alternative Parent Names: ["1-hydroxy-2-unsubstituted benzenoids", "1-hydroxy-4-unsubstituted benzenoids", "4'-hydroxyflavonoids", "5-hydroxyflavonoids", "7-hydroxyflavonoids", "Benzene and substituted derivatives", "Chromones", "Heteroaromatic compounds", "Hydrocarbon derivatives", "Organic oxides", "Organooxygen compounds", "Oxacyclic compounds", "Pyranones and derivatives", "Vinylogous acids"]
External Descriptor Annotations: ["Flavones and Flavonols", "flavones", "trihydroxyflavone"]
Substituent Names: ["1-benzopyran", "1-hydroxy-2-unsubstituted benzenoid", "1-hydroxy-4-unsubstituted benzenoid", "4'-hydroxyflavonoid", "5-hydroxyflavonoid", "7-hydroxyflavonoid", "Aromatic heteropolycyclic compound", "Benzenoid", "Benzopyran", "Chromone", "Flavone", "Heteroaromatic compound", "Hydrocarbon derivative", "Hydroxyflavonoid", "Monocyclic benzene moiety", "Organic oxide", "Organic oxygen compound", "Organoheterocyclic compound", "Organooxygen compound", "Oxacycle", "Phenol", "Pyran", "Pyranone", "Vinylogous acid"]

Spectra from Phytohub

Spectrum Type	Instrument Type	Ion Mode	Collision Energy Level	View	Peaks

GC-MS	GC-MS	Not Available	Not Available	View Spectrum	(177.0,0.013);(228.0,0.126);(327.0,0.039);(370.0,0.014);(399.0,0.072);(469.0,0.041);(471.0,1.0);(472.0,0.396);(473.0,0.18);(474.0,0.038)
GC-MS	GC-EI-TOF	positive	Not Available	View Spectrum	(85.0,1.501502);(86.0,0.600601);(87.0,1.101101);(88.0,0.4004);(89.0,1.801802);(90.0,0.500501);(91.0,2.402402);(92.0,0.600601);(93.0,1.301301);(94.0,0.1001);(95.0,0.800801);(96.0,0.600601);(97.0,0.500501);(98.0,0.4004);(99.0,4.004004);(100.0,0.500501);(101.0,1.501502);(102.0,0.600601);(103.0,2.202202);(104.0,0.700701);(105.0,2.002002);(106.0,0.600601);(107.0,1.401401);(108.0,0.1001);(109.0,0.700701);(110.0,0.2002);(111.0,0.600601);(112.0,0.1001);(113.0,0.900901);(114.0,0.4004);(115.0,3.303303);(116.0,0.700701);(117.0,1.501502);(118.0,0.800801);(119.0,2.202202);(120.0,0.600601);(121.0,2.302302);(122.0,0.700701);(123.0,1.401401);(124.0,0.4004);(125.0,0.800801);(126.0,0.600601);(127.0,0.900901);(128.0,0.800801);(129.0,1.201201);(130.0,0.3003);(131.0,1.501502);(132.0,0.700701);(133.0,5.805806);(134.0,1.501502);(135.0,3.603604);(136.0,0.600601);(137.0,2.302302);(138.0,0.800801);(139.0,1.601602);(140.0,0.500501);(141.0,1.001001);(142.0,0.600601);(143.0,1.301301);(144.0,0.1001);(145.0,1.801802);(146.0,0.900901);(147.0,6.706707);(148.0,1.401401);(149.0,2.502503);(150.0,1.701702);(151.0,2.302302);(152.0,1.301301);(153.0,1.201201);(154.0,0.600601);(155.0,1.201201);(156.0,0.700701);(157.0,0.500501);(158.0,0.2002);(159.0,1.201201);(160.0,0.4004);(161.0,1.401401);(162.0,1.001001);(163.0,1.901902);(164.0,0.900901);(165.0,2.802803);(166.0,0.800801);(167.0,1.201201);(168.0,0.800801);(169.0,1.501502);(170.0,0.600601);(171.0,0.500501);(172.0,0.1001);(173.0,0.4004);(174.0,0.3003);(175.0,3.603604);(176.0,1.801802);(177.0,3.803804);(178.0,2.402402);(179.0,1.901902);(180.0,0.500501);(181.0,0.800801);(182.0,0.3003);(183.0,1.901902);(184.0,1.201201);(185.0,0.800801);(186.0,0.4004);(187.0,0.4004);(188.0,0.1001);(189.0,1.401401);(190.0,0.900901);(191.0,1.601602);(192.0,2.502503);(193.0,2.802803);(194.0,0.500501);(195.0,1.101101);(196.0,0.4004);(197.0,0.4004);(198.0,0.2002);(199.0,0.4004);(200.0,0.3003);(201.0,0.3003);(202.0,0.500501);(203.0,0.600601);(204.0,0.2002);(205.0,1.401401);(206.0,0.500501);(207.0,1.501502);(208.0,0.500501);(209.0,1.301301);(210.0,0.600601);(211.0,0.500501);(212.0,0.500501);(213.0,1.701702);(214.0,0.3003);(215.0,0.500501);(216.0,0.1001);(217.0,1.601602);(218.0,0.500501);(219.0,0.900901);(220.0,1.501502);(221.0,2.102102);(222.0,1.101101);(223.0,2.202202);(224.0,0.800801);(225.0,1.201201);(226.0,0.500501);(227.0,1.801802);(228.0,23.823824);(229.0,6.806807);(230.0,0.800801);(231.0,0.4004);(232.0,0.1001);(233.0,0.500501);(234.0,0.3003);(235.0,1.301301);(236.0,0.500501);(237.0,1.001001);(238.0,0.4004);(239.0,0.700701);(240.0,0.3003);(241.0,0.3003);(242.0,0.3003);(243.0,0.3003);(245.0,0.1001);(247.0,0.500501);(248.0,0.1001);(249.0,0.700701);(250.0,0.3003);(251.0,1.001001);(252.0,0.600601);(253.0,1.701702);(254.0,0.500501);(255.0,0.500501);(256.0,0.1001);(258.0,0.1001);(259.0,0.700701);(260.0,0.2002);(261.0,0.2002);(262.0,0.2002);(263.0,0.3003);(264.0,0.1001);(265.0,0.800801);(266.0,0.4004);(267.0,0.900901);(268.0,0.500501);(269.0,0.900901);(270.0,0.500501);(271.0,0.2002);(272.0,0.1001);(274.0,0.1001);(275.0,0.3003);(277.0,0.500501);(278.0,0.3003);(279.0,1.101101);(280.0,1.101101);(281.0,3.103103);(282.0,1.301301);(283.0,0.900901);(284.0,0.1001);(285.0,0.1001);(289.0,0.1001);(290.0,0.2002);(291.0,0.700701);(292.0,0.4004);(293.0,1.001001);(294.0,0.600601);(295.0,1.801802);(296.0,0.800801);(297.0,3.203203);(298.0,2.902903);(299.0,1.601602);(300.0,0.600601);(301.0,0.2002);(302.0,0.1001);(305.0,0.1001);(306.0,0.3003);(307.0,0.500501);(308.0,0.500501);(309.0,4.004004);(310.0,1.801802);(311.0,1.501502);(312.0,0.700701);(313.0,0.800801);(314.0,0.2002);(315.0,0.1001);(320.0,0.1001);(321.0,0.3003);(322.0,0.4004);(323.0,0.900901);(324.0,1.901902);(325.0,2.102102);(326.0,1.601602);(327.0,8.708709);(328.0,3.003003);(329.0,1.701702);(330.0,0.4004);(331.0,0.2002);(333.0,0.1001);(335.0,0.1001);(337.0,0.3003);(338.0,0.4004);(339.0,1.101101);(340.0,2.102102);(341.0,1.701702);(342.0,0.900901);(343.0,0.4004);(344.0,0.1001);(345.0,0.1001);(350.0,0.2002);(351.0,0.3003);(352.0,0.4004);(353.0,0.900901);(354.0,1.401401);(355.0,1.101101);(356.0,0.600601);(357.0,1.501502);(358.0,0.700701);(359.0,0.4004);(360.0,0.1001);(363.0,0.3003);(364.0,0.1001);(365.0,0.2002);(366.0,0.2002);(367.0,0.900901);(368.0,2.102102);(369.0,3.903904);(370.0,5.305305);(371.0,3.303303);(372.0,1.301301);(373.0,0.3003);(380.0,0.3003);(381.0,1.901902);(382.0,1.901902);(383.0,2.302302);(384.0,1.201201);(385.0,2.902903);(386.0,1.301301);(387.0,0.3003);(390.0,0.1001);(395.0,0.600601);(396.0,1.601602);(397.0,2.402402);(398.0,4.204204);(399.0,10.810811);(400.0,5.705706);(401.0,3.803804);(402.0,2.002002);(403.0,0.600601);(406.0,0.1001);(411.0,0.3003);(412.0,0.1001);(413.0,0.500501);(414.0,1.201201);(415.0,0.600601);(416.0,0.1001);(423.0,0.1001);(425.0,0.3003);(426.0,0.3003);(427.0,0.2002);(428.0,0.2002);(429.0,0.1001);(430.0,0.1001);(431.0,0.1001);(432.0,0.1001);(434.0,0.1001);(437.0,0.1001);(438.0,0.1001);(439.0,0.3003);(440.0,0.600601);(441.0,2.402402);(442.0,1.801802);(443.0,0.700701);(444.0,0.4004);(445.0,0.1001);(446.0,0.1001);(452.0,0.1001);(453.0,0.2002);(454.0,0.3003);(455.0,0.600601);(456.0,0.4004);(457.0,0.2002);(466.0,0.1001);(467.0,0.500501);(468.0,1.601602);(469.0,6.406406);(470.0,26.226226);(471.0,100.0);(472.0,55.355355);(473.0,25.525526);(474.0,8.708709);(475.0,2.802803);(476.0,0.600601);(477.0,0.2002);(479.0,0.1001);(485.0,1.201201);(486.0,0.700701);(487.0,0.4004);(488.0,0.2002);(492.0,0.1001)
GC-MS	GC-EI-TOF	positive	Not Available	View Spectrum	(85.0,7.107107);(86.0,1.701702);(87.0,2.302302);(88.0,0.900901);(89.0,4.504505);(90.0,3.003003);(91.0,11.211211);(92.0,5.005005);(93.0,5.305305);(94.0,2.402402);(95.0,6.606607);(96.0,2.002002);(97.0,1.601602);(98.0,1.001001);(99.0,25.925926);(100.0,3.703704);(101.0,8.708709);(102.0,1.501502);(103.0,4.104104);(104.0,0.800801);(105.0,6.206206);(106.0,1.901902);(107.0,8.608609);(108.0,1.301301);(109.0,3.203203);(111.0,6.206206);(112.0,0.2002);(113.0,4.004004);(114.0,0.700701);(115.0,15.615616);(116.0,2.002002);(117.0,2.402402);(118.0,1.301301);(119.0,5.305305);(120.0,1.301301);(121.0,10.41041);(122.0,2.402402);(123.0,17.017017);(124.0,0.900901);(125.0,7.307307);(126.0,0.2002);(127.0,0.3003);(128.0,5.205205);(130.0,0.800801);(131.0,2.602603);(133.0,5.205205);(134.0,2.302302);(135.0,12.612613);(136.0,3.603604);(137.0,4.704705);(139.0,6.306306);(140.0,5.205205);(141.0,1.301301);(142.0,0.900901);(143.0,2.402402);(144.0,0.600601);(145.0,6.306306);(146.0,2.702703);(147.0,4.004004);(148.0,2.802803);(149.0,7.007007);(150.0,5.405405);(151.0,7.407407);(152.0,4.704705);(153.0,10.41041);(154.0,0.600601);(155.0,6.006006);(156.0,0.600601);(157.0,3.803804);(159.0,3.903904);(160.0,1.401401);(161.0,5.905906);(162.0,1.101101);(163.0,6.106106);(164.0,3.303303);(165.0,7.407407);(166.0,1.501502);(167.0,4.604605);(168.0,3.503504);(169.0,1.701702);(170.0,1.701702);(171.0,2.602603);(172.0,0.900901);(173.0,2.802803);(174.0,0.2002);(175.0,24.524525);(176.0,9.109109);(177.0,10.41041);(178.0,5.005005);(179.0,5.705706);(180.0,2.102102);(181.0,3.103103);(182.0,2.702703);(183.0,1.501502);(184.0,2.602603);(185.0,4.104104);(187.0,0.800801);(189.0,2.102102);(190.0,1.001001);(191.0,6.706707);(192.0,47.247247);(193.0,27.827828);(194.0,4.504505);(195.0,5.305305);(196.0,2.902903);(197.0,2.602603);(199.0,1.201201);(200.0,2.302302);(201.0,0.500501);(203.0,0.800801);(204.0,1.301301);(206.0,1.001001);(207.0,4.304304);(208.0,1.501502);(209.0,3.203203);(210.0,0.600601);(211.0,2.002002);(212.0,0.900901);(213.0,0.2002);(215.0,0.800801);(217.0,3.003003);(219.0,1.701702);(220.0,0.500501);(221.0,1.701702);(222.0,1.901902);(223.0,6.106106);(224.0,3.403403);(225.0,16.316316);(226.0,1.701702);(227.0,2.802803);(228.0,0.2002);(229.0,0.4004);(230.0,0.700701);(231.0,0.3003);(233.0,0.700701);(234.0,1.801802);(236.0,0.2002);(238.0,0.500501);(239.0,0.800801);(241.0,1.601602);(242.0,0.4004);(245.0,0.2002);(247.0,0.500501);(251.0,0.600601);(252.0,2.002002);(253.0,1.301301);(254.0,0.900901);(255.0,1.501502);(256.0,0.600601);(258.0,1.301301);(260.0,0.500501);(261.0,0.800801);(264.0,0.800801);(265.0,0.2002);(267.0,0.4004);(269.0,1.301301);(270.0,1.801802);(274.0,1.301301);(276.0,0.2002);(277.0,1.101101);(279.0,0.600601);(280.0,1.201201);(281.0,1.001001);(283.0,2.402402);(284.0,1.701702);(285.0,1.101101);(289.0,0.800801);(293.0,1.001001);(295.0,3.103103);(296.0,0.2002);(297.0,3.003003);(298.0,0.700701);(299.0,0.600601);(302.0,1.001001);(306.0,0.900901);(307.0,1.001001);(309.0,7.107107);(310.0,1.401401);(311.0,4.604605);(312.0,2.002002);(313.0,6.906907);(314.0,1.101101);(316.0,2.902903);(321.0,0.800801);(323.0,4.004004);(324.0,0.800801);(325.0,3.903904);(326.0,3.203203);(327.0,5.105105);(328.0,2.502503);(329.0,1.501502);(330.0,0.2002);(331.0,0.700701);(333.0,0.4004);(336.0,0.500501);(338.0,0.4004);(339.0,1.301301);(340.0,14.314314);(341.0,4.504505);(342.0,4.804805);(347.0,0.600601);(353.0,2.002002);(357.0,0.600601);(359.0,0.800801);(360.0,0.600601);(361.0,1.401401);(362.0,1.301301);(367.0,1.801802);(369.0,1.501502);(370.0,0.800801);(371.0,3.403403);(372.0,0.800801);(374.0,1.701702);(379.0,0.800801);(381.0,1.901902);(382.0,0.800801);(383.0,0.2002);(385.0,1.001001);(386.0,0.800801);(387.0,1.901902);(390.0,0.3003);(391.0,0.3003);(396.0,4.804805);(397.0,4.704705);(398.0,8.008008);(399.0,54.254254);(400.0,29.92993);(401.0,12.012012);(402.0,2.702703);(404.0,0.1001);(405.0,1.001001);(408.0,0.3003);(409.0,1.901902);(410.0,1.401401);(411.0,1.501502);(412.0,2.802803);(413.0,27.427427);(414.0,100.0);(415.0,48.948949);(416.0,21.121121);(417.0,6.306306);(418.0,0.800801);(419.0,1.801802);(420.0,0.2002);(421.0,0.4004);(422.0,0.2002);(424.0,0.4004);(425.0,0.3003);(429.0,0.600601);(430.0,0.3003);(436.0,0.4004);(437.0,0.4004);(441.0,1.001001);(442.0,1.901902);(444.0,0.600601);(454.0,0.1001);(460.0,1.801802);(462.0,0.2002);(466.0,0.600601);(467.0,0.2002);(469.0,0.800801);(472.0,0.700701);(475.0,0.1001);(476.0,0.600601);(477.0,0.600601);(483.0,0.800801);(486.0,1.001001);(490.0,1.001001);(492.0,0.2002);(494.0,0.4004)
GC-MS	GC-MS	Not Available	Not Available	View Spectrum	(177.0,0.013);(228.0,0.126);(327.0,0.039);(370.0,0.014);(399.0,0.072);(469.0,0.041);(471.0,1.0);(472.0,0.396);(473.0,0.18);(474.0,0.038)
Predicted GC-MS	GC-MS	Positive	Not Available	View Spectrum	(116.0256639,1.310830415);(117.0334885,2.003116563);(118.0413131,4.717412423);(119.0491377,2.81834851);(144.020578,2.648612767);(145.0284026,1.917173959);(150.0311413,5.087438991);(151.0389659,1.82345671);(152.0104062,2.572506799);(153.0182308,2.017290077);(160.0154921,1.457007091);(200.0104062,1.699546413);(200.0467905,1.90120375);(202.0260554,1.17669546);(213.0546151,1.01865693);(226.0260554,4.204901644);(227.03388,1.498007041);(228.0417046,7.058116128);(229.0450924,1.046158988);(229.0495292,4.232765729);(239.03388,1.280103119);(240.0417046,1.471462855);(241.0495292,2.031679635);(242.0573538,11.02265103);(243.0607448,1.760479098);(252.0417046,2.93787017);(253.0495292,2.729605514);(254.0209695,2.040619959);(255.0287941,2.329680584);(270.0522679,17.23459929);(271.0556584,2.952002358)
Predicted GC-MS	GC-MS	Positive	Not Available	View Spectrum	(41.00219012,1.388789733);(73.04679982,9.85923521);(99.02606472,0.9231305696);(113.0417139,1.625108686);(115.0573631,1.89909408);(190.0808369,1.001402207);(191.0886615,1.770011331);(217.0679264,1.596562846);(252.0996256,0.9244664262);(253.1074502,0.9145175857);(279.0867151,0.9865608076);(281.06598,0.962437228);(297.0972784,1.051776165);(372.1207522,1.19774552);(373.1285768,1.483563474);(385.1285768,1.106992087);(397.1285768,0.855486627);(399.1078417,3.855667857);(400.1100719,1.274190021);(412.1156663,1.017762853);(413.1234909,3.99865652);(414.1257615,1.367404166);(414.1313155,3.388603551);(415.1335879,1.159295222);(415.1391401,1.966696231);(443.1524514,1.162107137);(458.1759252,0.9613044113);(470.1395409,1.050361163);(471.1473655,5.74327418);(472.1493741,2.388559673);(473.1477092,1.104049694)
Predicted GC-MS	GC-MS	Ei	Not Available	View Spectrum	(39.99436552,0.9712599377);(79.01783932,0.7388869294);(116.0256639,0.9736264696);(117.0334885,1.90953388);(118.0413131,3.587290974);(119.0491377,2.265819033);(144.020578,2.419067932);(145.0284026,1.384538604);(150.0311413,3.015956473);(151.0389659,1.185393173);(152.0104062,1.075475508);(153.0182308,0.8808852901);(200.0104062,1.179354967);(200.0467905,1.676682706);(202.0624397,0.9421371925);(213.0546151,0.7654597448);(226.0260554,3.159465726);(227.03388,1.358476715);(228.0417046,4.158327577);(229.0495292,2.684047569);(239.03388,1.025101633);(240.0417046,1.181627964);(241.0495292,1.892414057);(242.0573538,8.374951335);(243.0607448,1.337602608);(252.0417046,1.202075179);(253.0495292,1.137680318);(254.0209695,1.601115437);(255.0287941,1.922387758);(270.0522679,14.4774428);(271.0556584,2.479746964)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(105.038,84.0);(107.017,266.0);(117.038,999.0);(118.041,81.0);(121.033,43.0);(149.029,309.0);(151.008,494.0);(152.011,26.0);(157.07,21.0);(159.049,111.0);(181.068,31.0);(182.076,23.0);(183.049,42.0);(197.067,24.0);(199.047,18.0);(201.061,64.0);(224.056,31.0);(225.061,152.0);(226.061,18.0);(227.04,122.0);(269.052,823.0);(270.056,99.0);(271.057,20.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(112.9855,3.0);(146.9607,3.0);(161.0238,2.0);(174.9554,6.0);(218.9833,2.0);(242.9434,3.0);(248.9615,2.0);(268.0378,10.0);(269.046,999.0);(270.0492,178.0);(271.0511,24.0);(272.0529,3.0);(304.9139,3.0);(310.93,2.0);(337.0313,2.0);(352.9976,4.0);(357.9768,2.0);(368.97,4.0);(399.0045,2.0);(459.9742,3.0);(539.0994,2.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(105.038,84.0);(107.017,266.0);(117.038,999.0);(118.041,81.0);(121.033,43.0);(149.029,309.0);(151.008,494.0);(152.011,26.0);(157.07,21.0);(159.049,111.0);(181.068,31.0);(182.076,23.0);(183.049,42.0);(197.067,24.0);(199.047,18.0);(201.061,64.0);(224.056,31.0);(225.061,152.0);(226.061,18.0);(227.04,122.0);(269.052,823.0);(270.056,99.0);(271.057,20.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(112.9855,3.0);(146.9607,3.0);(161.0238,2.0);(174.9554,6.0);(218.9833,2.0);(242.9434,3.0);(248.9615,2.0);(268.0378,10.0);(269.046,999.0);(270.0492,178.0);(271.0511,24.0);(272.0529,3.0);(304.9139,3.0);(310.93,2.0);(337.0313,2.0);(352.9976,4.0);(357.9768,2.0);(368.97,4.0);(399.0045,2.0);(459.9742,3.0);(539.0994,2.0)
LC-MS/MS	DI-ESI-qTof	Negative	Not Available	View Spectrum	(117.03624,19794.0);(118.039093,990.0);(121.030891,1477.0);(135.046524,267.0);(141.035614,292.0);(148.016159,332.0);(149.024963,16681.0);(150.027863,772.0);(151.004623,24215.0);(152.00795,954.0);(155.050568,361.0);(156.056717,225.0);(157.065735,835.0);(159.04567,6216.0);(160.049377,307.0);(161.024765,834.0);(169.051514,1032.0);(171.044662,328.0);(173.061142,313.0);(180.058624,1380.0);(181.066528,4097.0);(182.048996,418.0);(183.046158,4553.0);(184.048325,273.0);(185.026077,1176.0);(186.564682,232.0);(195.045822,289.0);(196.053574,735.0);(197.060715,1844.0);(199.040222,622.0);(200.731003,256.0);(201.055695,5600.0);(202.058792,429.0);(209.024826,384.0);(213.056427,683.0);(223.040314,220.0);(224.048599,1269.0);(225.055984,10060.0);(226.053513,851.0);(227.034943,6905.0);(228.038971,522.0);(233.090973,349.0);(241.049637,1152.0);(251.034286,312.0);(268.035858,238.0);(269.044739,65655.0);(270.04834,5279.0);(274.569305,234.0);(275.031006,271.0);(766.504822,422.0)
LC-MS/MS	DI-ESI-qTof	Positive	Not Available	View Spectrum	(115.051987,557.0);(119.047302,2490.0);(120.05027,111.0);(121.026581,1722.0);(125.01973,280.0);(128.059143,162.0);(131.045425,480.0);(135.022308,125.0);(139.050568,250.0);(141.066406,1343.0);(145.024261,4913.0);(146.027985,268.0);(147.039963,109.0);(153.015198,18184.0);(154.017273,821.0);(155.045624,1075.0);(157.061707,255.0);(159.038376,108.0);(163.033234,1087.0);(168.054047,593.0);(169.060944,1031.0);(171.02533,1797.0);(172.027664,113.0);(173.055267,193.0);(179.044464,263.0);(185.051147,113.0);(187.034821,472.0);(197.054398,969.0);(200.038818,139.0);(201.048523,168.0);(202.058792,129.0);(203.062637,165.0);(215.067307,139.0);(225.050201,462.0);(229.043671,546.0);(242.051453,317.0);(243.060669,1299.0);(244.0616,199.0);(253.04422,400.0);(271.054901,7359.0)
LC-MS/MS	LC-ESI-qTof	Positive	Not Available	View Spectrum	(59.016556,49.0);(67.05407,8.0);(67.056381,11.0);(67.058693,11.0);(71.013359,3.0);(71.015739,3.0);(78.959976,90.0);(78.968758,8.0);(78.971268,6.0);(81.068703,6.0);(81.071243,9.0);(83.048195,5.0);(83.052048,7.0);(89.020676,3.0);(89.026001,7.0);(91.056686,4.0);(93.069405,10.0);(93.072128,16.0);(93.077583,5.0);(95.084862,11.0);(95.087616,11.0);(96.968933,10.0);(96.97171,8.0);(96.973099,8.0);(105.070267,9.0);(105.071716,9.0);(105.076057,5.0);(107.085381,24.0);(107.088303,18.0);(109.096039,4.0);(109.103416,13.0);(109.107834,4.0);(109.110786,3.0);(113.060867,3.0);(115.050888,4.0);(115.053909,3.0);(117.065903,8.0);(117.070488,16.0);(117.072014,16.0);(119.079926,4.0);(119.083008,8.0);(119.08609,7.0);(119.090714,8.0);(121.100258,33.0);(121.103363,31.0);(121.106468,24.0);(121.992027,6.0);(121.99826,28.0);(122.001381,30.0);(122.006058,16.0);(123.112518,7.0);(123.115646,14.0);(123.117218,14.0);(123.120346,15.0);(123.123482,7.0);(123.128181,3.0);(126.070045,3.0);(127.073769,3.0);(127.078545,3.0);(131.083206,9.0);(131.086426,10.0);(131.088043,10.0);(131.092896,8.0);(133.090103,4.0);(133.099869,33.0);(133.1129,6.0);(133.11615,3.0);(134.984283,4.0);(134.987564,4.0);(135.113876,30.0);(135.117157,36.0);(135.120438,27.0);(135.123734,18.0);(135.130295,3.0);(137.12648,11.0);(137.129791,16.0);(137.133102,20.0);(139.578934,3.0);(139.58226,3.0);(140.011215,365.0);(141.090668,5.0);(143.07959,6.0);(143.084656,9.0);(143.086349,9.0);(143.088043,9.0);(143.091415,6.0);(145.099442,4.0);(145.104553,6.0);(145.107941,3.0);(147.106049,3.0);(147.116333,28.0);(149.057495,7.0);(149.062668,3.0);(149.093689,3.0);(149.131622,35.0);(149.140228,18.0);(149.147125,3.0);(151.143265,10.0);(151.146729,13.0);(151.151932,10.0);(152.083618,4.0);(152.984985,4.0);(152.993713,21.0);(152.997208,15.0);(153.088028,4.0);(153.093262,8.0);(155.101471,3.0);(155.103226,3.0);(155.10498,3.0);(155.10675,3.0);(157.099762,4.0);(157.103302,5.0);(158.111694,4.0);(159.11618,9.0);(159.119751,7.0);(161.132919,25.0);(161.136505,21.0);(161.147263,3.0);(163.07402,19.0);(163.075821,19.0);(163.084839,6.0);(163.133514,3.0);(163.138916,9.0);(163.146133,32.0);(163.153351,25.0);(163.156952,13.0);(163.162369,4.0);(165.155518,4.0);(165.162781,6.0);(165.168213,4.0);(166.102051,3.0);(167.106018,10.0);(167.111496,5.0);(167.115143,4.0);(171.117081,4.0);(172.124969,3.0);(173.126526,4.0);(173.132095,6.0);(173.135803,3.0);(173.137665,3.0);(175.143951,24.0);(175.14769,29.0);(175.151428,23.0);(175.157028,12.0);(177.084778,7.0);(177.090408,10.0);(177.092285,10.0);(177.096039,8.0);(177.099792,7.0);(177.161804,87.0);(177.171188,47.0);(177.176834,15.0);(178.015869,4.0);(178.021515,9.0);(178.025284,10.0);(178.03093,9.0);(178.036591,5.0);(179.108063,3.0);(179.109955,3.0);(181.118149,7.0);(181.121948,7.0);(181.125748,8.0);(183.135635,3.0);(183.139465,3.0);(185.131638,3.0);(187.146194,8.0);(187.148117,8.0);(187.151978,6.0);(187.153915,6.0);(189.150284,3.0);(189.159988,16.0);(189.163879,17.0);(189.169693,13.0);(189.175522,4.0);(189.17746,4.0);(191.098694,4.0);(191.104553,5.0);(191.108459,4.0);(191.11235,3.0);(191.163101,3.0);(191.168961,20.0);(191.176758,53.0);(191.180664,58.0);(191.202133,3.0);(193.112015,3.0);(193.119858,8.0);(193.123779,7.0);(193.131638,3.0);(195.131943,4.0);(195.13588,6.0);(196.032181,360.0);(196.036133,380.0);(201.158661,9.0);(201.164658,8.0);(201.168671,5.0);(201.172668,3.0);(203.103424,6.0);(203.109451,7.0);(203.11348,4.0);(203.173843,25.0);(203.179886,21.0);(203.185913,11.0);(203.189941,8.0);(205.120224,5.0);(205.126282,5.0);(207.130722,4.0);(207.134781,3.0);(207.13681,3.0);(207.142914,4.0);(207.149002,3.0);(209.146942,3.0);(209.151031,4.0);(213.150986,3.0);(213.161285,4.0);(213.165421,5.0);(214.038132,19.0);(214.046387,33.0);(214.054657,20.0);(214.062912,9.0);(215.173462,6.0);(215.177597,5.0);(215.181732,5.0);(215.185883,5.0);(217.120178,7.0);(217.126419,3.0);(217.13266,5.0);(217.190918,10.0);(217.195068,10.0);(217.201309,7.0);(219.130005,4.0);(219.132095,4.0);(219.136276,4.0);(219.140457,6.0);(219.144638,5.0);(221.146988,4.0);(221.157486,3.0);(221.159576,3.0);(221.161682,3.0);(227.174637,4.0);(227.178894,5.0);(229.125656,4.0);(229.191895,352.0);(231.12793,5.0);(231.132217,7.0);(231.136505,8.0);(231.142944,7.0);(233.156158,3.0);(235.171585,3.0);(241.180054,3.0);(241.184433,8.0);(241.18663,8.0);(241.19101,11.0);(241.195404,12.0);(241.199783,12.0);(243.135147,6.0);(243.141754,6.0);(245.146759,4.0);(245.151169,4.0);(245.155594,4.0);(249.161407,3.0);(249.172546,29.0);(249.17923,60.0);(249.185913,72.0);(249.208206,7.0);(249.212662,4.0);(255.19603,6.0);(255.205048,21.0);(255.209564,23.0);(255.211823,23.0);(255.216324,20.0);(255.22084,16.0);(255.2276,5.0);(255.232117,4.0);(257.143616,4.0);(257.152679,7.0);(257.157196,8.0);(263.23465,3.0);(271.160767,4.0);(271.165405,9.0);(271.174713,4.0);(280.340149,3.0);(280.34726,9.0);(280.35672,15.0);(280.36615,24.0);(280.37088,20.0);(280.37561,19.0);(280.380341,16.0);(280.385071,12.0);(280.389801,9.0);(280.396881,4.0);(280.403992,4.0);(281.246155,11627.0);(281.288757,15.0);(281.295868,8.0);(281.407166,3.0);(281.594269,3.0);(282.220001,3.0);(282.234222,4.0);(282.238953,10.0);(282.243713,13.0);(282.248444,18.0);(282.253204,16.0);(282.265045,9.0);(282.272156,4.0);(282.340942,4.0);(282.348053,10.0);(282.357544,9.0);(282.359924,9.0);(282.364685,10.0);(282.371796,6.0);(282.376526,3.0);(282.381287,5.0);(282.642273,3.0);(282.827423,4.0);(283.024506,3.0);(283.186005,4.0);(283.209778,7.0);(283.240662,2971.0);(283.285797,5.0);(283.399872,3.0);(283.492554,3.0);(283.573364,3.0);(283.582886,3.0);(283.713623,3.0);(283.806366,3.0);(283.820648,3.0);(283.918152,3.0);(284.022827,3.0);(284.037109,3.0);(284.10611,3.0);(284.220337,4.0);(284.234619,5.0);(284.237,5.0);(284.24176,6.0);(284.244141,6.0);(284.24649,6.0);(284.251251,9.0);(284.256012,6.0);(284.353607,3.0);(284.448853,3.0);(284.453613,3.0);(284.482178,5.0);(284.489319,5.0);(284.49408,5.0);(284.501221,6.0);(284.505981,3.0);(284.515503,3.0);(284.525024,3.0);(284.789398,4.0);(284.944275,3.0);(285.075348,3.0);(285.175476,3.0);(285.180237,3.0);(285.184998,4.0);(285.194519,4.0);(285.526001,3.0);(285.721619,3.0);(286.485718,4.0);(286.507233,4.0);(286.523956,3.0);(291.209656,4.0);(291.212067,4.0);(291.216888,4.0);(309.20462,8.0);(309.212067,21.0);(309.219513,23.0);(309.229431,17.0);(309.244324,4.0);(309.249298,3.0);(325.201111,3.0);(325.20874,4.0);(325.211273,4.0);(325.218933,9.0);(326.189575,11.0);(326.204865,20.0);(326.215088,15.0);(326.220184,11.0);(326.235474,5.0);(326.24823,4.0);(327.194885,7.0);(327.230621,7351.0);(327.274048,17.0);(327.279144,5.0);(327.299591,6.0);(327.411957,3.0);(328.204285,3.0);(328.214508,3.0);(328.222168,8.0);(328.227295,16.0);(328.232422,15.0);(328.240082,15.0);(328.252869,6.0);(328.257996,6.0);(328.787628,3.0);(329.230591,4.0);(330.622925,3.0);(330.628052,3.0);(330.638306,4.0);(330.658844,3.0);(330.671692,5.0);(404.236938,3.0);(404.239777,3.0);(404.256805,6.0);(404.259644,6.0);(404.276672,5.0);(417.233826,8.0);(417.239594,7.0);(417.251129,4.0);(417.253998,4.0);(450.23172,4.0);(450.234711,4.0);(450.237732,4.0);(450.243713,4.0);(450.249695,6.0);(460.240265,4.0);(460.27359,110.0);(460.276611,110.0);(460.282684,126.0);(460.291748,103.0);(460.306915,46.0);(460.315979,17.0);(460.322052,13.0);(476.79776,5.0);(478.241455,5.0);(478.253815,28.0);(478.293945,982.0);(478.3526,6.0);(479.288544,4.0);(479.300903,4.0);(506.257477,40.0);(506.263824,44.0);(506.270172,44.0);(506.301941,9.0);(506.308289,5.0);(524.229797,3.0);(524.239502,5.0);(524.245972,10.0);(524.262085,26.0);(524.27179,36.0);(524.284729,40.0);(524.294434,29.0);(524.304138,14.0);(524.313843,5.0);(524.320312,5.0);(785.964478,4.0);(785.976379,3.0);(785.98822,8.0);(786.004028,10.0);(786.01593,13.0);(786.023865,13.0);(786.031738,14.0);(786.04364,13.0);(786.051575,15.0);(786.055481,15.0);(786.067383,9.0);(786.07135,9.0);(786.079224,6.0);(786.087158,9.0);(786.09906,5.0);(787.540405,3.0);(787.568115,3.0);(787.580017,3.0);(788.328918,3.0);(788.34082,3.0);(788.364624,4.0);(788.45575,11.0);(788.463684,21.0);(788.519165,4038.0);(788.590576,29.0);(788.602417,10.0);(789.490662,13.0);(789.498596,18.0);(789.506531,23.0);(789.518433,27.0);(789.534302,28.0);(789.542236,24.0);(789.558105,18.0);(789.570007,11.0);(790.133362,4.0);(792.897583,3.0);(792.90155,3.0);(792.913452,3.0);(792.925415,4.0);(792.937317,7.0);(792.953186,7.0);(798.045593,3.0)
LC-MS/MS	LC-ESI-qTof	Positive	Not Available	View Spectrum	(45.100727,40.0);(45.187653,204.0);(45.233158,76.0);(45.290737,168.0);(45.314854,128.0);(46.329391,148.0);(46.360558,148.0);(47.493603,200.0);(48.187454,200.0);(48.619503,220.0);(49.014458,128.0);(49.265606,96.0);(49.443657,144.0);(49.820393,124.0);(49.97646,72.0);(50.048244,88.0);(50.172237,60.0);(50.58334,164.0);(50.959171,192.0);(51.327839,188.0);(51.569115,160.0);(51.899822,160.0);(52.123753,236.0);(52.152496,140.0);(52.181248,208.0);(52.596157,164.0);(53.163528,168.0);(54.015911,44.0);(54.711525,68.0);(54.724777,160.0);(55.328651,148.0);(55.370113,132.0);(56.678131,136.0);(57.629116,92.0);(57.813606,148.0);(57.984745,132.0);(58.601727,124.0);(59.103706,208.0);(59.999557,156.0);(61.122528,164.0);(61.420101,128.0);(61.721531,88.0);(61.890526,120.0);(62.026829,140.0);(62.163284,148.0);(63.979473,168.0);(64.304665,120.0);(64.888557,112.0);(64.906197,208.0);(64.960732,168.0);(65.02652,168.0);(65.19355,232.0);(65.463814,100.0);(65.678177,212.0);(66.179169,188.0);(66.839821,156.0);(67.64119,92.0);(67.678841,64.0);(67.752548,204.0);(68.159241,128.0);(68.575829,116.0);(68.777061,180.0);(69.702881,140.0);(69.915741,152.0);(70.025627,152.0);(70.289032,168.0);(70.681725,192.0);(71.13929,92.0);(71.578125,196.0);(71.616859,176.0);(71.96933,144.0);(72.470001,196.0);(72.666687,140.0);(73.246407,116.0);(74.220589,52.0);(74.575958,236.0);(75.240906,196.0);(75.322075,152.0);(76.059746,148.0);(77.572174,64.0);(77.889793,188.0);(77.907364,276.0);(78.793541,184.0);(78.86599,172.0);(79.251793,212.0);(79.43795,204.0);(79.905197,176.0);(80.097458,156.0);(80.756119,200.0);(80.877792,232.0);(80.926125,48.0);(81.189545,240.0);(81.385147,180.0);(81.606155,112.0);(82.141045,252.0);(82.218628,164.0);(82.319725,168.0);(82.755516,208.0);(82.967491,216.0);(82.98381,168.0);(83.123482,124.0);(83.246925,152.0);(83.306862,172.0);(83.803551,180.0);(84.82151,180.0);(85.317169,140.0);(85.672363,136.0);(86.931541,248.0);(87.539429,160.0);(88.439331,56.0);(88.489876,160.0);(88.793449,208.0);(88.872238,116.0);(88.930412,168.0);(89.075005,220.0);(89.276115,108.0);(89.443565,124.0);(89.767632,144.0);(89.81855,136.0);(90.567085,212.0);(91.053635,488.0);(91.233162,32.0);(91.354874,160.0);(91.579491,40.0);(91.789131,136.0);(92.054382,128.0);(92.104034,172.0);(92.549644,164.0);(92.570709,120.0);(92.996323,184.0);(93.19989,168.0);(94.226868,172.0);(94.524635,192.0);(94.710495,172.0);(94.925629,204.0);(95.238098,192.0);(95.502441,196.0);(95.847031,168.0);(96.077103,144.0);(96.966827,192.0);(97.028534,280.0);(97.100151,216.0);(97.518356,176.0);(98.288383,164.0);(98.954491,196.0);(99.386589,248.0);(99.825592,148.0);(100.307419,160.0);(100.49688,192.0);(100.750443,172.0);(100.900337,96.0);(101.755836,172.0);(102.393295,120.0);(102.496033,180.0);(102.645203,188.0);(102.764214,248.0);(102.947899,188.0);(103.304596,204.0);(104.085976,92.0);(104.586105,36.0);(105.043388,224.0);(105.213974,208.0);(105.495903,176.0);(105.54702,124.0);(106.360367,84.0);(106.812439,84.0);(107.012062,152.0);(107.042953,216.0);(107.372688,168.0);(108.26136,200.0);(108.499649,204.0);(108.736122,156.0);(109.024803,244.0);(109.157852,164.0);(109.536644,196.0);(110.494881,212.0);(110.622536,124.0);(110.672783,128.0);(111.006096,208.0);(111.421562,92.0);(111.4888,168.0);(112.086449,64.0);(112.244545,76.0);(112.295158,176.0);(112.666679,144.0);(112.8125,236.0);(113.918716,132.0);(113.944206,188.0);(114.748718,144.0);(114.938553,192.0);(115.05143,508.0);(115.669487,160.0);(115.78511,172.0);(115.853653,168.0);(115.986519,244.0);(116.052979,152.0);(116.570297,136.0);(116.692818,180.0);(117.24173,140.0);(117.50264,192.0);(117.692581,96.0);(117.811371,156.0);(118.889679,68.0);(118.928749,176.0);(118.954796,148.0);(119.048904,2912.0);(119.174149,44.0);(119.271942,152.0);(119.37075,116.0);(119.911865,164.0);(120.053055,608.0);(120.47921,396.0);(120.713081,120.0);(120.765572,76.0);(120.866211,236.0);(120.964699,72.0);(121.028671,1812.0);(121.251633,96.0);(121.306427,128.0);(121.545494,60.0);(122.032951,372.0);(122.884895,136.0);(123.0364,216.0);(123.115074,180.0);(123.515129,172.0);(123.563797,140.0);(125.026451,392.0);(125.06617,60.0);(125.208664,184.0);(125.293312,184.0);(125.469376,148.0);(125.623253,64.0);(126.029594,184.0);(126.685127,120.0);(126.76355,192.0);(126.969795,76.0);(127.055626,288.0);(127.248055,140.0);(127.322151,200.0);(127.753067,164.0);(128.05983,148.0);(128.118423,120.0);(128.659683,144.0);(128.675491,172.0);(128.76355,196.0);(129.016037,196.0);(129.061859,144.0);(130.049591,244.0);(130.081375,180.0);(130.26532,184.0);(130.290298,96.0);(130.424377,144.0);(130.76329,124.0);(131.04866,176.0);(131.81691,56.0);(132.054672,200.0);(132.320816,196.0);(133.02507,184.0);(133.847015,188.0);(134.363327,180.0);(134.531799,160.0);(134.931473,208.0);(134.973083,40.0);(135.00882,204.0);(135.044785,228.0);(135.063278,36.0);(135.470703,124.0);(135.767395,164.0);(136.310608,176.0);(137.624374,104.0);(138.250839,196.0);(139.052368,436.0);(139.207321,108.0);(140.327362,200.0);(140.381607,92.0);(140.416977,208.0);(140.506607,196.0);(141.068253,780.0);(142.07309,160.0);(142.367111,140.0);(143.054276,148.0);(144.052139,316.0);(144.347443,96.0);(144.761429,128.0);(145.028061,2688.0);(145.064453,212.0);(145.197021,164.0);(145.463943,68.0);(145.934814,80.0);(146.034271,388.0);(146.076721,200.0);(146.107986,72.0);(146.199417,40.0);(147.006744,88.0);(147.045349,420.0);(147.346436,200.0);(147.779984,96.0);(147.816284,40.0);(148.029312,168.0);(148.053528,176.0);(148.26915,184.0);(148.890228,56.0);(148.972809,172.0);(149.020996,216.0);(149.310669,132.0);(149.661087,168.0);(150.041183,192.0);(150.419312,172.0);(151.04808,220.0);(151.355698,60.0);(152.010193,104.0);(152.064072,192.0);(152.245865,52.0);(152.412903,128.0);(152.839844,196.0);(152.961349,208.0);(153.018021,9344.0);(153.063141,276.0);(153.094299,64.0);(153.190369,40.0);(153.283981,36.0);(153.323425,68.0);(153.365311,84.0);(153.43187,76.0);(153.513245,112.0);(153.532974,52.0);(153.66864,40.0);(153.816711,40.0);(154.022278,1164.0);(154.085907,124.0);(154.545776,36.0);(154.684372,144.0);(154.803223,204.0);(155.01619,144.0);(155.048676,496.0);(155.078217,116.0);(155.226974,128.0);(155.326172,112.0);(155.65921,108.0);(155.924576,188.0);(155.994171,120.0);(156.04921,200.0);(156.374741,116.0);(156.509171,124.0);(156.927765,148.0);(157.064606,584.0);(158.066788,220.0);(158.126846,116.0);(158.387253,88.0);(159.046921,152.0);(159.079346,132.0);(159.830826,160.0);(160.048599,160.0);(160.331955,96.0);(160.38237,108.0);(160.611832,144.0);(161.051025,348.0);(161.119232,128.0);(161.306244,108.0);(161.870453,252.0);(161.999619,148.0);(163.011978,124.0);(163.038757,688.0);(163.403564,200.0);(163.441727,104.0);(164.040237,156.0);(166.802353,52.0);(167.041504,108.0);(167.654297,148.0);(168.055435,440.0);(168.327591,208.0);(169.023834,272.0);(169.064117,608.0);(170.041412,48.0);(170.15303,188.0);(171.026535,156.0);(171.072174,192.0);(171.544861,80.0);(172.043488,152.0);(173.05574,144.0);(173.1754,64.0);(173.437424,44.0);(175.070068,268.0);(176.068512,112.0);(176.150391,176.0);(176.361786,164.0);(176.806122,192.0);(177.054993,232.0);(179.038864,324.0);(179.056641,248.0);(181.148956,140.0);(182.743683,132.0);(183.821503,32.0);(184.047195,164.0);(184.194092,64.0);(184.445389,48.0);(184.79425,128.0);(185.06456,120.0);(185.119064,112.0);(185.403519,36.0);(185.845535,56.0);(187.041626,144.0);(188.041641,92.0);(188.16449,156.0);(188.998123,100.0);(189.701996,216.0);(191.289795,244.0);(191.981369,176.0);(192.116531,128.0);(192.282089,136.0);(192.489136,136.0);(193.113724,160.0);(194.403763,144.0);(194.579636,100.0);(194.701828,192.0);(194.96019,324.0);(195.015778,176.0);(196.042755,236.0);(196.218353,108.0);(197.055618,752.0);(198.057159,224.0);(199.033127,104.0);(199.29155,108.0);(200.045273,152.0);(200.087509,44.0);(200.983795,64.0);(201.04866,172.0);(201.254776,88.0);(201.687012,160.0);(202.065063,332.0);(203.029053,188.0);(203.069626,200.0);(204.071198,192.0);(205.227203,64.0);(205.381195,268.0);(206.990219,128.0);(207.485916,144.0);(207.884613,200.0);(208.051086,132.0);(208.631409,196.0);(210.074203,124.0);(211.034363,140.0);(211.244156,116.0);(211.762283,128.0);(212.039597,140.0);(212.52182,80.0);(213.646194,180.0);(213.867355,64.0);(214.062408,176.0);(214.298355,252.0);(214.359543,188.0);(215.068069,368.0);(215.097427,208.0);(216.076431,100.0);(216.515518,96.0);(217.049057,120.0);(217.861862,176.0);(217.970566,192.0);(219.062119,104.0);(219.188812,168.0);(220.711945,120.0);(222.953033,152.0);(225.056305,692.0);(226.061752,172.0);(226.126343,148.0);(227.031128,168.0);(227.058121,132.0);(227.703384,84.0);(227.805511,128.0);(228.039276,164.0);(229.048706,496.0);(229.680893,108.0);(230.052063,120.0);(230.571594,168.0);(231.043304,152.0);(235.020432,212.0);(235.777756,180.0);(237.118256,156.0);(237.501526,148.0);(237.578217,224.0);(238.121521,180.0);(238.736191,212.0);(241.049683,160.0);(242.05986,672.0);(243.066299,544.0);(243.107544,240.0);(243.452133,128.0);(243.595016,68.0);(244.035583,152.0);(244.069153,220.0);(244.173157,240.0);(244.991791,132.0);(245.044754,136.0);(245.48114,104.0);(246.86142,136.0);(247.058868,208.0);(247.975952,168.0);(251.211563,176.0);(251.804993,88.0);(252.686569,172.0);(252.9496,160.0);(253.050919,560.0);(254.049377,168.0);(255.548798,192.0);(255.733368,152.0);(255.819321,180.0);(256.14093,152.0);(257.295349,208.0);(259.115143,176.0);(260.189545,40.0);(264.434937,180.0);(265.513824,168.0);(267.603271,88.0);(269.070435,164.0);(269.1586,116.0);(269.253296,64.0);(269.282684,112.0);(269.831696,88.0);(269.929779,72.0);(270.046539,184.0);(270.191437,156.0);(270.220886,180.0);(270.361603,140.0);(270.456512,124.0);(270.656219,176.0);(270.718414,100.0);(270.764282,148.0);(270.787201,160.0);(270.878906,88.0);(271.00528,280.0);(271.019043,204.0);(271.05954,23948.0);(271.133118,124.0);(271.179901,164.0);(271.26886,60.0);(271.294006,72.0);(271.322876,156.0);(271.448303,160.0);(271.619232,128.0);(271.670044,48.0);(271.716583,100.0);(271.773926,52.0);(271.845032,48.0);(271.924896,64.0);(272.022095,52.0);(272.063416,3456.0);(272.154694,44.0);(272.184235,88.0);(272.263062,40.0);(272.315613,60.0);(272.384583,112.0);(272.634277,44.0);(272.678864,64.0);(272.738922,124.0);(272.805206,68.0);(273.063446,820.0);(273.166931,200.0);(273.209717,88.0);(273.272217,76.0);(273.368713,160.0);(273.56842,196.0);(273.818665,128.0);(273.93396,60.0);(273.983368,116.0);(274.042664,36.0);(274.107635,192.0);(274.144806,92.0);(274.171173,140.0);(274.34259,44.0);(274.487671,100.0);(274.789581,148.0);(274.961487,108.0);(275.094727,112.0);(275.263123,76.0);(276.377075,88.0);(277.065735,80.0);(277.161835,92.0);(279.436249,92.0);(281.025543,100.0);(282.087585,56.0);(284.398865,124.0);(289.046356,176.0);(308.998779,144.0);(310.02475,132.0);(314.918671,120.0);(320.313812,72.0);(327.013275,148.0);(331.219818,164.0);(335.026855,72.0);(338.394196,56.0);(343.093201,144.0);(392.035004,88.0);(395.989716,116.0);(404.1427,100.0);(429.104218,84.0);(433.398651,60.0);(464.088409,40.0);(467.202209,92.0);(473.313812,80.0);(635.910706,92.0);(676.536743,144.0);(677.665771,36.0);(689.431213,52.0);(712.017212,84.0);(737.548767,28.0);(879.786743,76.0);(953.911499,64.0);(968.622864,140.0);(993.766296,112.0);(1049.702515,80.0);(1061.102051,200.0);(1063.086914,96.0);(1076.96106,180.0);(1082.022583,184.0);(1087.220703,112.0);(1087.850708,192.0);(1090.87915,36.0);(1093.279907,104.0);(1108.495239,184.0);(1118.776978,180.0);(1120.235474,124.0);(1125.691284,192.0);(1144.958618,112.0);(1151.230469,140.0);(1166.842407,152.0);(1209.071411,144.0);(1224.122192,108.0);(1229.350586,144.0);(1242.603516,104.0);(1252.11438,176.0);(1252.290405,168.0);(1265.184692,80.0);(1272.082397,120.0);(1273.019653,164.0);(1273.317993,180.0);(1275.961426,132.0);(1280.658081,64.0);(1285.962769,196.0);(1295.989014,176.0);(1300.786987,204.0);(1303.322144,124.0);(1304.342773,152.0);(1305.716064,148.0);(1310.150146,164.0);(1316.230347,220.0);(1327.004272,208.0);(1330.603027,160.0);(1343.032471,120.0);(1358.94397,132.0);(1359.509033,256.0);(1372.559082,132.0);(1384.04187,256.0);(1385.301025,128.0);(1389.994263,92.0);(1419.219971,120.0);(1427.991333,124.0);(1431.581177,124.0);(1432.168701,160.0);(1432.763794,208.0);(1435.439575,220.0);(1436.638794,104.0);(1444.041382,88.0);(1445.577271,196.0);(1455.902466,168.0);(1457.117798,168.0);(1478.12439,200.0);(1483.646729,176.0);(1488.74939,140.0);(1493.291504,216.0);(1496.615967,176.0);(1497.940674,176.0);(1500.568604,64.0);(1500.707397,140.0);(1502.573853,216.0)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(269.0458,100.0);(270.0491,15.631853);(271.0507,2.090186)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(149.0238,1.167933);(151.0031,1.344813);(225.0556,1.134117);(269.0455,100.0);(270.049,15.804807);(271.0516,2.463323)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(107.014,4.915171);(117.0345,26.775117);(118.0377,2.213223);(121.0293,1.612791);(149.0244,18.019968);(150.0276,1.940934);(151.0037,32.423375);(152.0071,1.975843);(159.0451,5.320115);(169.0139,1.347483);(181.0658,3.476925);(183.0453,3.637506);(197.0605,1.80828);(201.0557,5.417859);(224.0479,1.131048);(225.056,12.232074);(226.0593,1.473155);(227.0349,6.765342);(241.0513,1.117084);(269.0455,100.0);(270.0487,16.162815);(271.0512,2.08057)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(105.035,2.358439);(107.0139,11.16183);(117.0344,100.0);(118.0378,9.41202);(121.0295,8.173025);(148.0161,1.336811);(149.0243,16.769916);(150.0271,1.467232);(151.0036,26.344963);(152.0074,2.097598);(157.0652,1.271601);(159.0451,8.020867);(169.0659,1.271601);(180.0578,1.499837);(181.0654,3.140963);(183.0452,4.608195);(185.0243,1.673731);(197.0604,1.34768);(201.0561,2.597544);(225.0559,4.57559);(227.0349,5.966743);(269.0454,13.705032);(270.0487,2.369308)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(105.0348,1.528763);(107.0141,4.901497);(117.0346,100.0);(118.0379,8.447597);(121.0291,6.138692);(149.0247,2.631994);(151.0035,3.530339);(159.0456,2.395587);(227.0355,1.410559)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(107.0134,5.691383);(117.0344,35.330661);(149.0245,8.136273);(151.0039,10.180361);(159.0452,2.164329);(201.0561,2.144289);(225.0562,4.368737);(227.035,2.204409);(269.045,100.0);(269.295,3.046092);(270.0498,3.667335)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(63.0579,2.084477);(65.0447,5.605367);(83.0508,5.501677);(105.0589,3.885331);(107.0476,17.307106);(108.3034,2.05703);(116.2101,2.982617);(117.067,100.0);(117.9082,11.174138);(118.7827,3.307411);(121.0637,7.885026);(149.059,9.655383);(151.0323,11.960964);(159.0711,4.923757);(183.0617,2.856054);(227.0514,3.194572);(269.058,2.711192)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(117.0346,41.121203);(151.0032,12.214219);(269.045,100.0)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(117.0339,1.109811);(149.025,0.698507);(151.0047,1.014077);(225.0546,0.76233);(269.0453,100.0)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(107.0133,1.955212);(117.0344,8.783297);(149.0237,7.794324);(151.0026,9.563866);(159.0438,1.125384);(181.0667,1.822591);(183.043,1.220113);(197.0625,0.541851);(201.0539,2.334129);(224.0456,0.852563);(225.0536,4.997916);(227.0363,2.455383);(269.0451,100.0)
LC-MS/MS	LC-ESI-QTOF	negative	Not Available	View Spectrum	(131.0479,10.233918);(141.0356,14.132554);(149.0239,60.331384);(151.0023,100.0);(154.0391,6.725146);(154.7646,7.407407);(159.0471,44.444444);(171.045,15.009747);(180.0574,14.230019);(181.0646,12.768031);(183.0465,21.345029);(185.026,7.11501);(196.0575,10.038986);(227.0341,10.331384);(269.0365,7.894737)
LC-MS/MS	Linear Ion Trap	negative	Not Available	View Spectrum	(149.233095,6.640014);(151.203863,3.714332);(159.255635,1.147804);(181.28383,2.291258);(183.258548,2.986972);(185.227046,0.749142);(197.277923,1.396344);(201.274231,5.157824);(224.250005,1.207833);(225.269284,21.369016);(227.21867,3.750049);(241.243754,0.987397);(269.286042,100.0);(270.000006,48.774355)
LC-MS/MS	Linear Ion Trap	negative	Not Available	View Spectrum	(107.16021,1.68293);(117.167136,1.751618);(121.178792,0.681059);(149.189128,32.70695);(151.157229,16.612758);(157.251237,0.764552);(159.217923,5.18831);(169.223357,1.599891);(180.224423,1.58346);(181.239482,9.906135);(182.209769,0.844778);(183.196119,14.531517);(184.14341,0.71626);(185.174827,3.588749);(196.231674,1.521884);(197.233018,6.977354);(199.201276,0.596525);(201.203716,25.056885);(204.182549,0.562823);(207.21279,0.550206);(210.190034,0.818194);(213.200482,1.453085);(224.199437,5.936463);(225.180903,100.0);(226.12964,3.226164);(227.130588,16.201882);(241.156897,4.738583);(251.169171,1.712264);(269.160442,96.292775);(270.114854,59.219966)
LC-MS/MS	LC-ESI-TOF	negative	Not Available	View Spectrum	(105.038,8.408408);(107.017,26.626627);(117.038,100.0);(118.041,8.108108);(121.033,4.304304);(149.029,30.930931);(151.008,49.449449);(152.011,2.602603);(157.07,2.102102);(159.049,11.111111);(181.068,3.103103);(182.076,2.302302);(183.049,4.204204);(197.067,2.402402);(199.047,1.801802);(201.061,6.406406);(224.056,3.103103);(225.061,15.215215);(226.061,1.801802);(227.04,12.212212);(269.052,82.382382);(270.056,9.90991);(271.057,2.002002)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(271.0603,100.0);(272.0636,13.118431);(273.0658,1.691045)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(271.0605,100.0);(272.0638,12.153442);(273.066,1.706098)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(119.0491,1.912597);(153.0183,8.186741);(271.0603,100.0);(272.0636,12.891487);(273.0658,1.621137)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(91.0542,1.708776);(111.0079,1.011801);(119.0493,22.879376);(120.0526,1.724616);(121.0285,7.037066);(135.0077,1.065262);(141.0699,2.40575);(145.0285,10.628861);(153.0183,84.369555);(154.0217,5.399572);(155.0493,1.469191);(163.039,6.577697);(169.0648,2.348329);(171.0287,2.38199);(187.0387,2.003802);(197.0593,2.952241);(225.0543,2.86512);(229.0491,2.983922);(243.0649,5.258989);(253.0494,1.894899);(271.0599,100.0);(272.0633,12.777206);(273.0654,1.756297)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(91.0543,10.994596);(97.0287,2.183172);(111.0078,2.598332);(115.0545,4.602555);(119.0494,31.487778);(120.0527,2.784439);(121.0287,16.835475);(122.0324,1.166744);(125.0236,2.108013);(131.0495,2.551806);(135.008,1.878959);(141.0701,7.641101);(145.0288,26.37343);(146.0322,2.652017);(152.0619,1.173902);(153.0187,100.0);(154.022,6.467199);(155.0496,5.772879);(157.0649,1.266955);(163.0391,4.874557);(168.057,3.657707);(169.0647,4.441502);(171.0292,2.462331);(179.0501,1.198955);(187.0392,1.542536);(197.06,4.155184);(225.0546,1.299166);(229.0498,1.467378);(242.0576,1.646326);(243.0653,3.954762);(253.0497,1.753695);(271.0607,14.090405);(272.0641,2.040013)
LC-MS/MS	LC-ESI-ITFT	positive	Not Available	View Spectrum	(119.0491,1.110055);(121.0282,0.316214);(145.0283,0.303934);(153.0182,3.413743);(154.0216,0.238786);(163.0388,0.251937);(171.0286,0.117816);(187.0392,0.131982);(203.0703,0.111112);(225.0547,0.178079);(229.0489,0.26208);(243.0644,0.193038);(247.0612,0.135632);(271.0601,100.0)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(67.0075,9.490915);(68.987,9.686139);(91.0484,22.540922);(111.0044,3.048506);(119.0466,43.459979);(119.1016,4.460129);(121.026,16.699204);(141.0694,5.286079);(145.0276,17.089653);(153.0178,100.0);(153.0811,9.010362);(163.0387,7.268359);(169.065,3.138609);(197.0605,3.979577);(225.0558,4.054663);(229.0505,4.099715);(243.0665,7.238324);(271.0606,57.245833);(271.1428,3.484007)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(67.0076,1.335099);(68.9871,1.976543);(91.0487,3.587611);(115.0516,0.833504);(119.0468,5.060695);(121.0263,2.039941);(145.0279,2.565776);(153.0182,12.951948);(153.0808,0.837234);(163.0399,0.878256);(271.0606,100.0);(271.1437,5.342259);(272.0649,5.745026)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(91.0555,6.328761);(119.0497,7.644697);(153.0195,17.385971);(271.0606,100.0)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(67.0186,18.0406);(68.9985,16.131215);(91.0549,32.333039);(119.0501,46.837305);(121.0305,16.699029);(141.0732,6.013533);(145.0296,20.411886);(153.0198,100.0);(163.0419,7.166814);(243.0659,6.572521);(271.0606,37.010886)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(192.9629,7.34856);(271.0595,100.0)
LC-MS/MS	LC-ESI-QTOF	positive	Not Available	View Spectrum	(119.0504,3.576538);(153.0192,14.735336);(163.0339,5.436338);(163.0444,3.004292);(225.0566,2.86123);(271.0579,100.0)
LC-MS/MS	Linear Ion Trap	positive	Not Available	View Spectrum	(88.055454,1.81875);(91.037345,1.202674);(102.100307,0.593589);(119.049375,9.233686);(121.042569,6.595023);(145.061813,12.43169);(146.059997,0.62823);(153.037184,100.0);(154.044735,3.808075);(157.081047,0.753734);(161.105728,0.660016);(163.063556,5.157664);(173.100364,1.268856);(175.118518,0.514141);(185.117194,2.082644);(187.073399,2.401485);(197.10548,0.592218);(201.100504,1.149713);(203.129686,8.416031);(204.120124,0.632372);(211.087506,3.665015);(215.132316,1.138625);(225.124341,14.056901);(226.111717,1.340591);(227.164777,0.800832);(229.116268,27.009111);(230.108717,2.176779);(240.311648,2.238198);(242.118842,7.176423);(243.133753,13.271102);(244.13147,0.699386);(247.106961,1.145741);(249.198677,1.288775);(253.142843,1.733554);(254.262057,0.731535);(271.118307,67.19143);(272.124539,10.668133)
LC-MS/MS	Not Available	positive	Not Available	View Spectrum	(45.100727,0.167029);(45.187653,0.851846);(45.233158,0.317354);(45.290737,0.70152);(45.314854,0.534491);(46.329391,0.618006);(46.360558,0.618006);(47.493603,0.835143);(48.187454,0.835143);(48.619503,0.918657);(49.014458,0.534491);(49.265606,0.400869);(49.443657,0.601303);(49.820393,0.517789);(49.97646,0.300651);(50.048244,0.367463);(50.172237,0.250543);(50.58334,0.684817);(50.959171,0.801737);(51.327839,0.785034);(51.569115,0.668114);(51.899822,0.668114);(52.123753,0.985469);(52.152496,0.5846);(52.181248,0.868549);(52.596157,0.684817);(53.163528,0.70152);(54.015911,0.183731);(54.711525,0.283949);(54.724777,0.668114);(55.328651,0.618006);(55.370113,0.551194);(56.678131,0.567897);(57.629116,0.384166);(57.813606,0.618006);(57.984745,0.551194);(58.601727,0.517789);(59.103706,0.868549);(59.999557,0.651411);(61.122528,0.684817);(61.420101,0.534491);(61.721531,0.367463);(61.890526,0.501086);(62.026829,0.5846);(62.163284,0.618006);(63.979473,0.70152);(64.304665,0.501086);(64.888557,0.46768);(64.906197,0.868549);(64.960732,0.70152);(65.02652,0.70152);(65.19355,0.968766);(65.463814,0.417571);(65.678177,0.885251);(66.179169,0.785034);(66.839821,0.651411);(67.64119,0.384166);(67.678841,0.267246);(67.752548,0.851846);(68.159241,0.534491);(68.575829,0.484383);(68.777061,0.751629);(69.702881,0.5846);(69.915741,0.634709);(70.025627,0.634709);(70.289032,0.70152);(70.681725,0.801737);(71.13929,0.384166);(71.578125,0.81844);(71.616859,0.734926);(71.96933,0.601303);(72.470001,0.81844);(72.666687,0.5846);(73.246407,0.484383);(74.220589,0.217137);(74.575958,0.985469);(75.240906,0.81844);(75.322075,0.634709);(76.059746,0.618006);(77.572174,0.267246);(77.889793,0.785034);(77.907364,1.152497);(78.793541,0.768331);(78.86599,0.718223);(79.251793,0.885251);(79.43795,0.851846);(79.905197,0.734926);(80.097458,0.651411);(80.756119,0.835143);(80.877792,0.968766);(80.926125,0.200434);(81.189545,1.002171);(81.385147,0.751629);(81.606155,0.46768);(82.141045,1.05228);(82.218628,0.684817);(82.319725,0.70152);(82.755516,0.868549);(82.967491,0.901954);(82.98381,0.70152);(83.123482,0.517789);(83.246925,0.634709);(83.306862,0.718223);(83.803551,0.751629);(84.82151,0.751629);(85.317169,0.5846);(85.672363,0.567897);(86.931541,1.035577);(87.539429,0.668114);(88.439331,0.23384);(88.489876,0.668114);(88.793449,0.868549);(88.872238,0.484383);(88.930412,0.70152);(89.075005,0.918657);(89.276115,0.450977);(89.443565,0.517789);(89.767632,0.601303);(89.81855,0.567897);(90.567085,0.885251);(91.053635,2.037748);(91.233162,0.133623);(91.354874,0.668114);(91.579491,0.167029);(91.789131,0.567897);(92.054382,0.534491);(92.104034,0.718223);(92.549644,0.684817);(92.570709,0.501086);(92.996323,0.768331);(93.19989,0.70152);(94.226868,0.718223);(94.524635,0.801737);(94.710495,0.718223);(94.925629,0.851846);(95.238098,0.801737);(95.502441,0.81844);(95.847031,0.70152);(96.077103,0.601303);(96.966827,0.801737);(97.028534,1.1692);(97.100151,0.901954);(97.518356,0.734926);(98.288383,0.684817);(98.954491,0.81844);(99.386589,1.035577);(99.825592,0.618006);(100.307419,0.668114);(100.49688,0.801737);(100.750443,0.718223);(100.900337,0.400869);(101.755836,0.718223);(102.393295,0.501086);(102.496033,0.751629);(102.645203,0.785034);(102.764214,1.035577);(102.947899,0.785034);(103.304596,0.851846);(104.085976,0.384166);(104.586105,0.150326);(105.043388,0.93536);(105.213974,0.868549);(105.495903,0.734926);(105.54702,0.517789);(106.360367,0.35076);(106.812439,0.35076);(107.012062,0.634709);(107.042953,0.901954);(107.372688,0.70152);(108.26136,0.835143);(108.499649,0.851846);(108.736122,0.651411);(109.024803,1.018874);(109.157852,0.684817);(109.536644,0.81844);(110.494881,0.885251);(110.622536,0.517789);(110.672783,0.534491);(111.006096,0.868549);(111.421562,0.384166);(111.4888,0.70152);(112.086449,0.267246);(112.244545,0.317354);(112.295158,0.734926);(112.666679,0.601303);(112.8125,0.985469);(113.918716,0.551194);(113.944206,0.785034);(114.748718,0.601303);(114.938553,0.801737);(115.05143,2.121263);(115.669487,0.668114);(115.78511,0.718223);(115.853653,0.70152);(115.986519,1.018874);(116.052979,0.634709);(116.570297,0.567897);(116.692818,0.751629);(117.24173,0.5846);(117.50264,0.801737);(117.692581,0.400869);(117.811371,0.651411);(118.889679,0.283949);(118.928749,0.734926);(118.954796,0.618006);(119.048904,12.159679);(119.174149,0.183731);(119.271942,0.634709);(119.37075,0.484383);(119.911865,0.684817);(120.053055,2.538834);(120.47921,1.653583);(120.713081,0.501086);(120.765572,0.317354);(120.866211,0.985469);(120.964699,0.300651);(121.028671,7.566394);(121.251633,0.400869);(121.306427,0.534491);(121.545494,0.250543);(122.032951,1.553366);(122.884895,0.567897);(123.0364,0.901954);(123.115074,0.751629);(123.515129,0.718223);(123.563797,0.5846);(125.026451,1.63688);(125.06617,0.250543);(125.208664,0.768331);(125.293312,0.768331);(125.469376,0.618006);(125.623253,0.267246);(126.029594,0.768331);(126.685127,0.501086);(126.76355,0.801737);(126.969795,0.317354);(127.055626,1.20260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LC-MS/MS	Not Available	positive	Not Available	View Spectrum	(119.016281,0.53972);(147.201294,0.167966);(153.184509,1.744829);(162.908142,0.282628);(193.397797,0.097255);(203.00766,0.061072);(225.205933,0.111354);(229.207306,0.115094);(243.777863,0.216089);(246.863739,0.193862);(248.011047,0.268026);(253.913635,0.146386);(269.694458,0.228246);(270.486694,0.11941);(271.204407,100.0);(272.203491,19.5953);(273.531982,0.321832)
LC-MS/MS	Not Available	positive	Not Available	View Spectrum	(69.999573,0.026262);(72.528893,0.048031);(73.257294,0.041293);(74.834816,0.044748);(76.642708,0.041466);(77.040466,0.025052);(78.251678,0.01123);(79.017868,0.217694);(80.029732,0.022806);(80.464493,0.035246);(81.033333,0.078093);(81.357971,0.040083);(83.015503,0.087423);(84.433273,0.019178);(85.027199,0.055287);(85.068863,0.030581);(85.253967,0.048722);(85.887489,0.07723);(87.009415,0.027125);(87.236153,0.042157);(89.002968,0.042329);(89.019272,0.06479);(89.036705,0.096407);(89.056305,0.040602);(89.760689,0.029717);(90.378448,0.022288);(91.012383,0.038183);(91.054123,2.593842);(91.34494,0.02367);(92.058762,0.093125);(92.938011,0.069109);(94.038307,0.056324);(95.049362,0.197652);(96.455765,0.040602);(96.99202,0.052177);(97.028542,0.190223);(101.942276,0.02367);(102.203484,0.031272);(102.980232,0.02678);(103.017853,0.032654);(103.868973,0.010885);(103.986832,0.050623);(105.050941,0.035246);(105.071999,0.031963);(106.04631,0.093816);(107.012634,0.13459);(107.049736,0.01745);(107.480141,0.018659);(109.028191,0.030408);(109.380981,0.036801);(110.172844,0.041638);(110.381355,0.057188);(111.007431,0.167417);(111.04467,0.025225);(111.288269,0.019696);(112.682724,0.04924);(112.714699,0.030581);(113.590851,0.028853);(115.054192,0.332761);(116.057777,0.02367);(116.425018,0.038874);(116.995781,0.029026);(117.032402,0.114376);(117.068024,0.064617);(118.035088,0.064099);(118.71611,0.015895);(118.844658,0.045439);(119.016266,0.077402);(119.049431,5.062596);(119.256744,0.022115);(119.611473,0.03801);(120.052734,0.390467);(121.029266,2.195773);(121.29995,0.033);(122.031288,0.119732);(123.337677,0.057879);(123.56945,0.036282);(124.856796,0.037492);(125.021774,0.275919);(127.039902,0.138391);(127.355179,0.012612);(127.743286,0.048895);(128.215698,0.050277);(129.018646,0.226678);(129.074692,0.088805);(130.022354,0.030235);(131.050735,0.274191);(131.444336,0.041638);(132.0578,0.016932);(132.530197,0.043884);(133.37764,0.048722);(135.007782,0.166553);(135.040665,0.030235);(136.177689,0.040947);(137.037109,0.026434);(138.521896,0.033864);(139.008224,0.029717);(139.049957,0.068245);(139.869522,0.016932);(140.063217,0.065135);(141.070282,0.662412);(142.074829,0.0349);(143.034637,0.040947);(144.051285,0.091915);(144.981277,0.038528);(145.029358,3.119936);(145.063751,0.11403);(145.992065,0.040602);(146.032013,0.264343);(146.066299,0.027816);(147.048828,0.024015);(149.010651,0.028335);(149.568451,0.016932);(149.969147,0.038874);(152.061722,0.243092);(152.4021,0.029199);(152.55574,0.021942);(152.600952,0.049068);(152.759491,0.043193);(152.880081,0.069973);(153.018875,14.871958);(153.070557,0.028853);(153.142578,0.015895);(153.228043,0.014167);(154.022095,1.206301);(154.080353,0.016413);(154.198135,0.01745);(154.939529,0.027816);(155.023026,0.030063);(155.050888,0.347965);(155.087677,0.031963);(155.119904,0.012612);(155.260284,0.025916);(155.50531,0.012267);(156.051056,0.080685);(157.065491,0.05667);(157.631027,0.015204);(158.026474,0.031099);(158.665588,0.041811);(159.046661,0.032827);(161.061066,0.05045);(162.995773,0.036973);(163.039032,0.879415);(163.982712,0.017623);(164.040756,0.081722);(166.63913,0.047858);(166.958405,0.023152);(167.046906,0.02246);(168.054138,0.293196);(169.02742,0.077921);(169.063965,0.688155);(169.881531,0.019696);(169.932938,0.034382);(169.984512,0.02868);(170.027588,0.035764);(170.063782,0.064099);(171.030273,0.921226);(172.012421,0.025052);(172.03511,0.031099);(172.091019,0.053041);(173.058762,0.072737);(174.064911,0.022288);(175.027496,0.026262);(176.781387,0.042848);(177.682251,0.026262);(178.077835,0.018659);(179.060669,0.136663);(180.051819,0.02056);(180.559158,0.05667);(181.063538,0.029199);(182.027435,0.038528);(182.345322,0.019005);(183.044449,0.128198);(183.089508,0.027644);(183.614105,0.024534);(184.054352,0.02678);(185.061554,0.020042);(187.040848,0.454911);(188.050446,0.139255);(188.561661,0.024361);(188.967834,0.028853);(189.825226,0.039219);(191.918365,0.032481);(192.322983,0.042502);(192.369034,0.066172);(194.698212,0.053905);(194.999924,0.021942);(195.059769,0.02989);(196.056641,0.024534);(197.059692,0.581209);(198.060349,0.05045);(200.051483,0.030581);(201.055771,0.228924);(202.062088,0.190396);(202.406448,0.026262);(202.800629,0.064963);(203.031433,0.072565);(203.064606,0.076711);(203.436737,0.044575);(207.062424,0.042502);(209.069824,0.062717);(210.653122,0.039392);(211.036682,0.050104);(212.650589,0.054078);(213.062698,0.047167);(214.062744,0.024707);(215.073654,0.294578);(216.034683,0.037665);(217.283737,0.037146);(218.053711,0.030235);(219.060349,0.036801);(219.708038,0.039219);(219.973602,0.026262);(222.099518,0.043884);(225.054138,0.352803);(225.142578,0.033345);(225.327133,0.059952);(226.057236,0.07412);(226.214005,0.036628);(227.029419,0.088287);(227.235489,0.02678);(228.000427,0.025398);(228.807404,0.018832);(228.921341,0.064617);(229.049881,0.826028);(229.289871,0.02678);(230.051224,0.10781);(231.673935,0.019869);(232.115829,0.055978);(235.038513,0.043366);(237.431442,0.029544);(238.723694,0.015031);(241.041061,0.026089);(242.011826,0.015031);(242.056046,0.240673);(242.102554,0.018314);(242.221893,0.019005);(243.064209,0.812033);(244.043213,0.03611);(244.066528,0.051486);(245.048782,0.022115);(247.062759,0.09658);(248.032486,0.032481);(248.062439,0.038183);(251.341431,0.053905);(253.052765,0.427441);(254.237274,0.041466);(255.070419,0.033518);(255.996964,0.033864);(257.403381,0.050968);(258.22525,0.044748);(258.289703,0.028853);(258.390015,0.041984);(263.451904,0.034727);(267.178162,0.025398);(267.914734,0.02557);(268.144531,0.025398);(268.32663,0.013995);(268.605865,0.025743);(269.046265,0.031617);(269.278931,0.027298);(269.632324,0.042329);(269.745453,0.025916);(269.857544,0.031099);(269.975433,0.020733);(270.061493,0.042329);(270.334106,0.026607);(270.402496,0.034555);(270.470856,0.053041);(270.519409,0.033518);(270.596649,0.023152);(270.676819,0.043539);(270.790955,0.013995);(270.829651,0.031445);(270.868927,0.043539);(270.92218,0.029544);(271.061523,100.0);(271.151459,0.050968);(271.21582,0.087769);(271.280121,0.024361);(271.321167,0.040774);(271.355469,0.037146);(271.399261,0.024361);(271.472717,0.013476);(271.509216,0.015722);(271.57663,0.027816);(272.06485,8.45724);(272.212219,0.024707);(272.306488,0.027816);(272.34256,0.065827);(272.438141,0.025916);(273.058258,0.05045);(273.345856,0.018314);(273.53653,0.014686);(273.598938,0.023843);(273.743774,0.049413);(273.786469,0.039565);(273.848938,0.0349);(273.899323,0.046476);(273.94519,0.042675);(274.023468,0.027644);(274.046814,0.033518);(274.079956,0.060643);(274.228302,0.021078);(274.616486,0.01244);(274.672455,0.017105);(275.062744,0.015377);(275.177032,0.022979);(275.747253,0.020733);(277.040802,0.028335);(279.025879,0.015204);(282.706207,0.02367);(283.109222,0.010885);(285.501099,0.01244);(291.014557,0.014167);(291.343781,0.01555);(293.972443,0.010885);(299.031708,0.038528);(309.00769,0.050968);(317.036377,0.033691);(345.022858,0.052177);(362.025238,0.017968);(362.127563,0.022806);(363.036438,0.114376);(483.557312,0.016759);(637.023926,0.013649);(846.754883,0.022288);(1239.28418,0.051141);(1468.151367,0.04302);(1520.780884,0.039738);(1563.156006,0.048895);(1678.933228,0.043712);(1741.755005,0.013649);(1742.048462,0.019351);(1863.297485,0.046994);(1878.547119,0.055633);(1913.122437,0.042329);(1915.679199,0.049413);(1930.526733,0.032827);(1956.099121,0.02246);(1979.108276,0.052177)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(65.00095,1.8);(66.00433,2.8);(89.03706,2.6);(90.04832,1.6);(93.02959,2.0);(116.02611,1.7);(117.0336,100.0);(118.0351,8.1);(119.04031,1.4);(129.03276,1.1);(141.03554,1.2);(143.04716,1.5);(149.0209,1.1);(154.03317,1.4);(160.01183,1.3);(167.05545,1.1);(182.04207,3.1);(186.02574,1.3);(186.95294,1.2)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(105.035,2.4);(107.0139,11.21);(117.0344,100.0);(118.0378,9.41);(121.0295,8.21);(148.0161,1.3);(149.0243,16.82);(150.0271,1.5);(151.0036,26.33);(152.0074,2.1);(157.0652,1.3);(159.0451,8.01);(169.0659,1.3);(180.0578,1.5);(181.0654,3.1);(183.0452,4.6);(185.0243,1.7);(197.0604,1.3);(201.0561,2.6);(225.0559,4.6);(227.0349,6.01);(269.0454,13.71);(270.0487,2.4)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(225.05327,1.0);(269.04428,100.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(65.00127,2.6);(83.01176,4.8);(105.03127,3.8);(107.01323,15.1);(108.01571,2.4);(117.03335,100.0);(118.03674,8.9);(121.02832,10.8);(131.04897,1.3);(143.05573,1.1);(149.02277,10.6);(150.0298,1.7);(151.00183,15.6);(152.00645,1.6);(156.05206,1.1);(159.04449,4.7);(160.05019,1.2);(169.06277,1.8);(180.05687,2.2);(181.06339,4.2);(183.03983,4.7);(185.02319,1.2);(195.04373,1.1);(199.04353,1.3);(201.05351,2.5);(223.03023,1.1);(225.04665,2.3);(227.03876,2.7)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(117.0339,1.11);(151.0047,1.01);(269.0453,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(64.99973,1.0);(65.00385,1.4);(83.01096,3.1);(93.03236,1.9);(105.0327,1.5);(106.03706,1.1);(107.01327,20.62);(108.01859,1.3);(117.0331,100.0);(118.03668,5.51);(121.0279,7.01);(149.02216,12.31);(151.00124,13.11);(155.04657,1.7);(159.04269,5.91);(169.0648,1.1);(180.05353,1.5);(181.06586,2.1);(182.03886,2.1);(183.03915,3.0);(197.05957,1.0);(199.0416,1.1);(225.05281,1.4);(227.03639,3.1);(269.04111,3.1)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(91.0543,11.01);(97.0287,2.2);(111.0078,2.6);(115.0545,4.6);(119.0494,31.53);(120.0527,2.8);(121.0287,16.82);(122.0324,1.2);(125.0236,2.1);(131.0495,2.5);(135.008,1.9);(141.0701,7.61);(145.0288,26.33);(146.0322,2.6);(152.0619,1.2);(153.0187,100.0);(154.022,6.51);(155.0496,5.81);(157.0649,1.3);(163.0391,4.9);(168.057,3.7);(169.0647,4.4);(171.0292,2.5);(179.0501,1.2);(187.0392,1.5);(197.06,4.2);(225.0546,1.3);(229.0498,1.5);(242.0576,1.6);(243.0653,4.0);(253.0497,1.8);(271.0607,14.11);(272.0641,2.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(107.0133,1.96);(117.0344,8.78);(149.0237,7.79);(151.0026,9.56);(159.0438,1.13);(181.0667,1.82);(183.043,1.22);(201.0539,2.33);(225.0536,5.0);(227.0363,2.46);(269.0451,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(105.038,8.41);(107.017,26.63);(117.038,100.0);(118.041,8.11);(121.033,4.3);(149.029,30.93);(151.008,49.45);(152.011,2.6);(157.07,2.1);(159.049,11.11);(181.068,3.1);(182.076,2.3);(183.049,4.2);(197.067,2.4);(199.047,1.8);(201.061,6.41);(224.056,3.1);(225.061,15.22);(226.061,1.8);(227.04,12.21);(269.052,82.38);(270.056,9.91);(271.057,2.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(65.00127,2.6);(83.01176,4.8);(105.03127,3.8);(107.01323,15.12);(108.01571,2.4);(117.03335,100.0);(118.03674,8.91);(121.02832,10.81);(131.04897,1.3);(143.05573,1.1);(149.02277,10.61);(150.0298,1.7);(151.00183,15.62);(152.00645,1.6);(153.03764,1.0);(156.05206,1.1);(159.04449,4.7);(160.05019,1.2);(169.06277,1.8);(180.05687,2.2);(181.06339,4.2);(183.03983,4.7);(185.02319,1.2);(195.04373,1.1);(199.04353,1.3);(201.05351,2.5);(223.03023,1.1);(225.04665,2.3);(227.03876,2.7)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(131.0479,10.23);(141.0356,14.13);(149.0239,60.33);(151.0023,100.0);(154.0391,6.73);(154.7646,7.41);(159.0471,44.44);(171.045,15.01);(180.0574,14.23);(181.0646,12.77);(183.0465,21.34);(185.026,7.12);(196.0575,10.04);(227.0341,10.33);(269.0365,7.89)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(107.014,4.9);(117.0345,26.73);(118.0377,2.2);(121.0293,1.6);(149.0244,18.02);(150.0276,1.9);(151.0037,32.43);(152.0071,2.0);(159.0451,5.31);(169.0139,1.3);(181.0658,3.5);(183.0453,3.6);(197.0605,1.8);(201.0557,5.41);(224.0479,1.1);(225.056,12.21);(226.0593,1.5);(227.0349,6.81);(241.0513,1.1);(269.0455,100.0);(270.0487,16.12);(271.0512,2.1)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(65.0033,1.9);(89.0397,2.04);(91.0189,2.57);(105.0346,19.88);(115.0553,3.17);(131.0502,1.12);(133.0295,2.19);(139.0554,4.48);(141.0711,2.18);(143.0502,2.83);(152.0632,5.36);(153.071,12.67);(154.0425,8.56);(155.0502,2.59);(157.0658,10.75);(159.045,1.51);(161.0608,1.72);(167.0502,3.58);(168.0581,4.3);(169.0659,9.58);(171.0452,30.2);(172.0533,1.03);(173.0608,3.13);(175.0401,2.46);(179.0503,14.05);(180.0581,29.79);(181.0659,33.19);(182.0374,70.48);(183.0452,3.44);(184.0532,1.54);(185.0608,45.1);(186.0325,1.32);(187.04,1.69);(195.0451,25.32);(196.053,27.39);(197.0608,54.22);(198.0324,2.14);(199.04,7.54);(201.0558,1.89);(207.0451,7.75);(210.0322,30.88);(211.0402,1.33);(212.0481,4.76);(213.0558,25.62);(223.0402,3.59);(224.048,39.43);(225.0558,100.0);(226.0269,1.77);(227.0351,16.09);(240.0429,41.03);(241.0507,44.94);(256.0378,4.65);(268.0377,1.25);(269.0456,16.5)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(63.024,2.95);(65.0033,9.32);(77.0397,3.19);(89.0397,6.91);(91.019,5.12);(103.0552,1.08);(105.0346,43.11);(113.0397,2.48);(115.0553,16.66);(117.0347,1.94);(127.0553,3.55);(129.071,1.41);(130.0425,1.73);(131.0503,5.21);(133.0659,5.1);(139.0553,9.95);(141.0711,3.65);(143.0503,9.14);(151.0552,1.68);(152.0632,7.21);(153.071,10.26);(154.0425,22.0);(155.0503,5.03);(156.058,1.0);(157.0659,23.36);(158.0372,1.67);(159.0451,5.2);(161.0609,5.02);(167.0502,12.07);(168.0581,8.45);(169.066,7.44);(170.0372,1.38);(171.0452,49.63);(172.0529,1.94);(173.0609,5.05);(175.04,5.33);(178.0424,3.64);(179.0503,15.63);(180.0581,20.37);(181.066,11.3);(182.0374,100.0);(183.045,5.86);(184.053,5.86);(185.0608,67.79);(187.0403,3.58);(195.0451,75.02);(196.0529,34.61);(197.0608,26.51);(198.0323,4.91);(199.0401,8.58);(201.0554,1.28);(207.0452,3.52);(210.0323,13.26);(211.0401,4.59);(212.048,10.0);(213.0557,17.13);(223.0402,5.97);(224.0479,32.3);(225.0558,18.01);(226.0269,2.03);(227.035,5.92);(240.0428,50.75);(241.0508,13.58);(256.0376,3.75)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(119.0504,3.58);(153.0192,14.74);(163.0339,5.44);(163.0444,3.0);(225.0566,2.86);(271.0579,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(65.03483,6.9);(65.03978,19.2);(67.01427,25.4);(68.99747,32.1);(73.52916,3.9);(75.34854,5.2);(79.13167,8.8);(83.00916,4.5);(89.03913,7.3);(90.04076,4.7);(91.05392,100.0);(92.0603,5.6);(93.03342,13.1);(97.02903,4.5);(101.04426,4.3);(103.04748,5.6);(103.9942,4.5);(111.00974,3.7);(114.04651,5.2);(115.05171,40.1);(116.05569,5.2);(117.03778,4.3);(119.04794,22.4);(121.02531,78.0);(125.0203,9.3);(126.04385,6.9);(127.27699,4.3);(128.68771,4.1);(131.05118,9.3);(133.05104,4.5);(136.04422,7.1);(139.05119,11.2);(140.04305,14.4);(141.02977,11.2);(141.64745,6.5);(145.02591,30.2);(146.02811,5.8);(147.02505,5.0);(150.04506,6.2);(151.04945,7.1);(152.05887,9.3);(153.01775,81.5);(155.04906,8.2);(156.49477,4.3);(168.05603,4.3);(169.03369,5.0);(197.05728,4.1);(271.06427,20.5)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(91.05462,1.1);(119.04942,2.8);(145.02856,1.6);(153.01738,10.6);(154.02167,1.3);(271.05908,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(192.9629,7.35);(271.0595,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(53.0022,2.06);(55.0179,3.13);(63.0229,2.03);(65.0386,27.29);(67.0178,46.57);(68.9971,80.48);(79.0178,3.8);(81.0335,4.54);(83.0128,3.79);(85.0284,1.33);(89.0386,4.32);(91.0542,100.0);(92.9971,1.24);(95.0491,1.73);(97.0284,8.37);(111.044,2.85);(115.0542,13.45);(119.0492,41.76);(121.0284,25.17);(125.0235,2.85);(128.0621,1.47);(131.0492,3.83);(139.0542,1.11);(141.0699,8.53);(145.0284,29.9);(152.0622,1.01);(153.0183,76.74);(155.0491,5.52);(163.0388,2.87);(168.057,3.3);(169.0649,3.97);(171.0288,5.57);(173.0598,1.03);(187.0389,1.26);(197.0599,2.84);(243.0652,1.81);(271.0599,2.73)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(67.02027,1.5);(68.99817,2.5);(91.05431,6.2);(119.04879,31.1);(121.02364,5.8);(122.03085,1.3);(141.06892,1.2);(145.02773,9.4);(146.03064,1.8);(153.01724,71.6);(154.02525,3.0);(155.04814,1.7);(157.06436,2.3);(161.06154,1.2);(163.03937,8.3);(169.06354,1.4);(187.03648,3.8);(197.0563,2.8);(203.07237,1.1);(225.05623,5.1);(229.03831,1.7);(243.05989,3.5);(244.06757,1.2);(253.05624,2.0);(271.06061,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.06009,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(65.0385,5.76);(67.0178,33.16);(68.997,33.25);(79.0178,1.08);(81.0335,2.04);(83.0127,1.68);(85.0284,1.03);(91.0542,47.46);(95.049,1.28);(97.0283,3.01);(111.0076,2.58);(115.0542,3.8);(119.0491,60.07);(121.0283,21.62);(125.0233,2.62);(127.0387,1.31);(129.018,3.04);(131.0491,2.83);(141.0698,5.8);(145.0284,21.27);(153.0181,100.0);(155.0491,2.97);(157.0648,1.03);(163.0389,6.9);(168.0568,1.1);(169.0648,5.24);(171.0287,14.85);(185.0444,1.68);(187.0389,3.01);(197.0596,3.69);(225.0546,2.75);(229.0495,3.11);(243.0651,6.03);(253.049,1.41);(271.06,32.19)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(119.0491,1.11);(153.0182,3.41);(271.0601,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.02261,1.5);(271.05917,100.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(107.01163,3.5);(117.03395,15.8);(118.03574,2.4);(121.0279,1.9);(149.02225,9.2);(151.00127,9.3);(159.04366,2.7);(201.04913,2.0);(225.05281,3.0);(227.03009,1.6);(269.04428,100.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(269.04428,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(67.01517,3.0);(68.99669,2.5);(91.0515,2.6);(97.02612,1.5);(109.02715,1.6);(111.00645,1.7);(119.04906,31.6);(120.054,3.9);(121.02768,10.0);(125.0237,2.3);(141.06923,2.0);(145.02824,8.7);(146.03304,1.4);(153.01782,75.4);(154.02084,5.8);(163.03847,6.5);(187.03854,1.3);(197.05482,1.7);(203.0627,1.8);(225.05675,2.4);(229.04507,2.9);(243.06921,3.0);(244.0677,1.2);(271.06039,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(69.0331,1.48);(91.0536,16.74);(119.0487,9.42);(121.0284,3.01);(145.028,3.13);(153.0177,40.13);(154.021,3.01);(163.0385,3.38);(169.0652,1.54);(171.0287,3.36);(197.059,1.8);(225.0544,2.65);(229.0493,2.0);(243.0659,4.33);(253.0504,1.64);(271.0602,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(91.05567,1.2);(119.04874,3.7);(145.0266,1.1);(153.01784,9.0);(271.06018,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(56.02363,4.8);(63.0214,5.1);(65.03684,6.2);(67.01664,19.8);(68.99195,15.7);(69.63499,5.1);(72.7774,3.9);(77.03606,6.2);(79.01962,8.5);(81.02662,6.9);(89.04381,6.2);(91.05343,100.0);(93.0349,12.9);(94.03739,5.1);(97.03248,14.7);(102.04276,3.9);(109.37012,5.5);(110.99759,8.5);(112.97898,6.7);(115.05309,16.6);(116.05443,5.3);(117.03386,22.4);(118.03635,4.6);(119.04427,33.4);(120.05223,7.6);(121.02584,26.3);(125.01456,4.6);(126.0396,9.4);(131.04317,4.8);(135.01454,10.4);(139.05388,10.1);(140.05162,17.1);(141.06795,14.3);(143.04559,6.9);(145.02242,41.7);(146.03726,10.6);(152.05542,6.9);(153.01613,82.7);(154.02213,12.0);(155.05241,4.8);(156.06105,7.1);(162.04756,4.6);(163.04391,6.0);(164.06697,6.0);(168.05292,5.5);(169.03143,5.3);(173.06735,8.5);(195.04515,6.5);(199.55835,4.1);(208.78893,4.6);(213.04027,6.9);(230.05164,3.9);(242.05373,5.1)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(119.04974,1.8);(145.0276,1.8);(153.01733,8.6);(271.05966,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(91.0543,10.99);(97.0287,2.18);(111.0078,2.6);(115.0545,4.6);(119.0494,31.49);(120.0527,2.78);(121.0287,16.84);(122.0324,1.17);(125.0236,2.11);(131.0495,2.55);(135.008,1.88);(141.0701,7.64);(145.0288,26.37);(146.0322,2.65);(152.0619,1.17);(153.0187,100.0);(154.022,6.47);(155.0496,5.77);(157.0649,1.27);(163.0391,4.87);(168.057,3.66);(169.0647,4.44);(171.0292,2.46);(179.0501,1.2);(187.0392,1.54);(197.06,4.16);(225.0546,1.3);(229.0498,1.47);(242.0576,1.65);(243.0653,3.95);(253.0497,1.75);(271.0607,14.09);(272.0641,2.04)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(107.8646,29.7);(111.5794,29.59);(116.9649,28.1);(119.0448,62.69);(120.9783,52.72);(123.6532,29.83);(125.16,16.76);(127.214,25.73);(136.1144,16.63);(145.0156,69.91);(147.1346,19.99);(153.0183,100.0);(163.0386,88.24);(168.0488,46.0);(174.0312,20.99);(175.073,43.3);(179.0466,14.52);(183.0852,40.28);(212.7182,16.92);(225.0481,47.53);(230.1774,15.71);(232.6597,18.95);(241.0048,28.05);(244.9566,33.11);(249.4367,19.13);(259.2665,19.61);(262.0146,14.76);(262.6988,21.3);(271.066,39.89)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(63.0239,22.85);(65.0032,100.0);(67.0191,1.09);(77.0392,1.02);(79.0188,1.0);(81.0342,2.62);(83.0141,14.24);(93.0349,1.88);(105.035,2.54);(107.0137,8.53);(108.0172,1.17);(117.0349,38.7);(118.0385,3.01);(121.0296,1.77);(149.0251,5.2);(151.0048,8.53);(159.0457,1.88);(225.0565,2.17);(227.035,4.35);(269.0461,9.44)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(269.0461,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(103.6879,1.22);(104.5125,2.16);(119.0451,3.34);(130.8479,1.28);(145.0288,1.41);(146.3213,1.5);(155.0766,2.0);(157.2372,2.81);(164.5623,2.27);(167.4773,1.45);(176.7587,2.13);(179.5263,1.07);(184.1017,1.19);(185.605,1.47);(192.9389,5.1);(208.9331,2.36);(214.0053,2.16);(225.2569,1.03);(229.0401,1.63);(229.8575,2.01);(271.0625,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(67.0186,18.04);(68.9985,16.13);(91.0549,32.33);(119.0501,46.84);(121.0305,16.7);(141.0732,6.01);(145.0296,20.41);(153.0198,100.0);(163.0419,7.17);(243.0659,6.57);(271.0606,37.01)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(105.0348,1.53);(107.0141,4.9);(117.0346,100.0);(118.0379,8.45);(121.0291,6.14);(149.0247,2.63);(151.0035,3.53);(159.0456,2.4);(227.0355,1.41)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(65.0396,3.9);(66.44695,5.8);(67.021,4.0);(69.03329,5.6);(75.02665,3.4);(81.03368,7.2);(83.01089,3.1);(88.70135,3.4);(90.04435,6.1);(91.05802,25.6);(92.06134,4.3);(93.03365,5.5);(94.02106,3.1);(94.81652,2.7);(97.02624,3.4);(102.05062,2.7);(107.07176,2.7);(115.05725,8.8);(117.03522,7.4);(119.0488,16.9);(120.0471,6.1);(121.02747,13.5);(125.01841,4.5);(126.02386,4.2);(128.05693,6.6);(129.01283,2.7);(131.08942,3.2);(137.03654,2.9);(139.05432,11.4);(141.07558,7.6);(143.04652,10.0);(144.05573,2.7);(145.02382,21.1);(150.04802,5.6);(152.06725,4.3);(153.01888,100.0);(154.01918,2.7);(155.05191,5.8);(160.05409,6.3);(163.0519,6.4);(168.06053,5.8);(179.04019,5.6);(200.0587,4.0);(242.06186,4.0);(271.06128,4.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(106.7998,1.25);(116.0492,3.36);(119.9976,1.18);(144.9869,1.89);(187.2967,1.31);(192.9371,2.13);(202.8174,1.35);(231.935,1.15);(240.5592,1.01);(254.2042,3.44);(271.0609,100.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(269.046,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.0601,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(119.0491,1.91);(153.0183,8.19);(271.0603,100.0);(272.0636,12.89);(273.0658,1.62)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(149.0238,1.17);(151.0031,1.34);(225.0556,1.13);(269.0455,100.0);(270.049,15.8);(271.0516,2.46)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(67.01846,3.7);(68.99823,2.9);(81.03424,1.2);(91.05708,4.2);(111.0102,2.0);(119.04877,27.6);(120.05514,2.2);(121.02738,9.3);(125.0275,1.5);(141.06992,2.0);(145.02806,8.8);(146.0314,2.1);(153.01752,70.9);(154.02061,6.5);(163.03841,6.7);(169.05861,1.3);(187.037,2.1);(197.06244,1.4);(203.06908,1.2);(211.0407,1.2);(225.05698,3.7);(229.05348,2.2);(243.06668,3.3);(244.06731,1.4);(253.05513,1.5);(271.0596,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.06134,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.0602,100.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(269.0458,100.0);(270.0491,15.63);(271.0507,2.09)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(91.0542,1.71);(111.0079,1.01);(119.0493,22.88);(120.0526,1.72);(121.0285,7.04);(135.0077,1.07);(141.0699,2.41);(145.0285,10.63);(153.0183,84.37);(154.0217,5.4);(155.0493,1.47);(163.039,6.58);(169.0648,2.35);(171.0287,2.38);(187.0387,2.0);(197.0593,2.95);(225.0543,2.87);(229.0491,2.98);(243.0649,5.26);(253.0494,1.89);(271.0599,100.0);(272.0633,12.78);(273.0654,1.76)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.0605,100.0);(272.0638,12.15);(273.066,1.71)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(119.0492,1.73);(153.0182,4.74);(271.0601,100.0)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(107.014,4.92);(117.0345,26.78);(118.0377,2.21);(121.0293,1.61);(149.0244,18.02);(150.0276,1.94);(151.0037,32.42);(152.0071,1.98);(159.0451,5.32);(169.0139,1.35);(181.0658,3.48);(183.0453,3.64);(197.0605,1.81);(201.0557,5.42);(224.0479,1.13);(225.056,12.23);(226.0593,1.47);(227.0349,6.77);(241.0513,1.12);(269.0455,100.0);(270.0487,16.16);(271.0512,2.08)
LC-MS/MS	Not Available	Negative	Not Available	View Spectrum	(105.035,2.36);(107.0139,11.16);(117.0344,100.0);(118.0378,9.41);(121.0295,8.17);(148.0161,1.34);(149.0243,16.77);(150.0271,1.47);(151.0036,26.34);(152.0074,2.1);(157.0652,1.27);(159.0451,8.02);(169.0659,1.27);(180.0578,1.5);(181.0654,3.14);(183.0452,4.61);(185.0243,1.67);(197.0604,1.35);(201.0561,2.6);(225.0559,4.58);(227.0349,5.97);(269.0454,13.71);(270.0487,2.37)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(67.0178,7.31);(68.9971,4.3);(91.0543,6.35);(119.0492,25.03);(121.0284,6.8);(129.0182,1.82);(141.0699,1.08);(145.0284,5.94);(153.0183,45.64);(163.039,4.13);(169.065,1.03);(171.0288,9.02);(185.0447,1.14);(187.0392,1.73);(197.06,1.22);(225.0548,2.16);(229.0497,2.23);(243.0652,3.43);(271.0602,100.0)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(271.0603,100.0);(272.0636,13.12);(273.0658,1.69)
LC-MS/MS	Not Available	Positive	Not Available	View Spectrum	(91.0542,1.7);(111.0079,1.0);(119.0493,22.92);(120.0526,1.7);(121.0285,7.01);(135.0077,1.1);(141.0699,2.4);(145.0285,10.61);(153.0183,84.38);(154.0217,5.41);(155.0493,1.5);(163.039,6.61);(169.0648,2.3);(171.0287,2.4);(187.0387,2.0);(197.0593,2.9);(225.0543,2.9);(229.0491,3.0);(243.0649,5.31);(253.0494,1.9);(271.0599,100.0);(272.0633,12.81);(273.0654,1.8)
Predicted LC-MS/MS	Not Available	Positive	low	View Spectrum	(43.01838972,0.0304263725);(51.0234751,0.0010598984);(55.01838972,0.3538970154);(68.99765427,0.012760742);(69.03403978,0.0250097493);(79.01838972,0.0697250681);(89.03912516,0.0007205023);(91.01838972,0.0002930648);(92.99765427,0.0002756988);(109.0289544,0.00195914);(119.0496898,0.1991534576);(127.0395191,0.0081729126);(145.0289544,0.021388721);(153.0187836,0.6955650793);(175.0395191,0.0002928481);(185.023869,0.0004582942);(193.0500838,0.0210035618);(199.0395191,0.0029354304);(203.0344337,0.0359213313);(211.0395191,0.0025969268);(217.0500838,0.1655601238);(223.0395191,0.0072490354);(225.0187836,0.0020465492);(227.0344337,0.0089895906);(229.0500838,0.2090825644);(241.0500838,0.5828273755);(243.0293483,0.23112014);(245.0449984,0.1314096884);(253.0500838,2.148424036);(255.0293483,0.2651829984);(271.0606485,94.76449208)
Predicted LC-MS/MS	Not Available	Positive	med	View Spectrum	(27.0234751,0.031432143);(43.01838972,0.0691425817);(51.0234751,0.0914240151);(55.01838972,0.1582773162);(68.99765427,0.2075988951);(69.03403978,0.314228395);(77.03912516,0.0074697304);(79.01838972,0.7534887622);(89.03912516,0.0116705356);(109.0289544,0.0115674278);(111.008219,0.0092696269);(119.0496898,0.400143126);(127.0395191,0.0190762498);(145.0289544,0.3401896771);(153.0187836,1.176610487);(179.0344337,0.0073718126);(193.0500838,0.1274646669);(199.0395191,0.0674686924);(203.0344337,0.7078416741);(211.0395191,0.0892994078);(217.0500838,0.6749772443);(223.0395191,0.1258608583);(225.0187836,0.0595622817);(227.0344337,0.0595034731);(229.0500838,4.062407311);(241.0500838,3.392864273);(243.0293483,0.8228724572);(245.0449984,0.5407797816);(253.0500838,4.021420507);(255.0293483,0.6216174936);(271.0606485,81.0170991)
Predicted LC-MS/MS	Not Available	Positive	high	View Spectrum	(43.01838972,1.552513363);(51.0234751,1.744527066);(55.01838972,4.658203497);(67.01838972,0.8873323777);(68.99765427,3.997446142);(77.03912516,1.149445208);(79.01838972,5.974442531);(85.0289544,3.699686474);(89.03912516,3.305918842);(91.01838972,0.6204740456);(93.03403978,0.635883675);(109.0289544,4.951972715);(111.008219,2.079169654);(115.0183897,1.36843397);(119.0496898,5.019386267);(127.0395191,1.105743629);(145.0289544,3.660792465);(153.0187836,15.56922932);(199.0395191,1.793607169);(203.0344337,1.170163178);(211.0395191,2.34315299);(217.0500838,1.186439329);(223.0395191,4.858324057);(227.0344337,1.739580835);(229.0500838,3.571493705);(241.0500838,6.149688887);(243.0293483,1.212885784);(245.0449984,0.6919954709);(253.0500838,8.248031004);(255.0293483,0.7142032547);(271.0606485,4.339833096)
Predicted LC-MS/MS	Not Available	Negative	low	View Spectrum	(17.00273965,0.151066192);(41.00273965,0.0739094758);(63.0234751,0.0000575348);(65.00273965,0.0002476031);(67.01838972,0.0079322862);(75.0234751,0.0000578753);(77.00273965,0.0012178268);(83.01330434,0.0013134282);(87.0234751,0.0001242249);(91.01838972,0.0001535484);(107.0133043,0.0056371971);(117.0340398,0.2696942691);(125.023869,0.1997914242);(143.0133043,0.0209165671);(151.0031336,0.6457893805);(159.0446045,0.0001739602);(173.023869,0.0003209579);(185.023869,0.0005253699);(191.0344337,0.0172647159);(197.023869,0.0006092183);(201.0187836,0.0136373366);(201.0551691,0.0170752245);(215.0344337,0.0255118545);(221.023869,0.0005816627);(227.0344337,0.2021116754);(239.0344337,0.1778928158);(241.0136983,0.0728762262);(243.0293483,0.3413684417);(251.0344337,0.7755250698);(253.0136983,0.0328878411);(269.0449984,96.9437288)
Predicted LC-MS/MS	Not Available	Negative	med	View Spectrum	(17.00273965,0.1338694169);(41.00273965,0.1028190994);(49.00782503,0.0030817657);(65.00273965,0.0056103624);(67.01838972,0.1939989766);(75.0234751,0.0026046564);(77.00273965,0.0166180993);(83.01330434,0.0502210749);(107.0133043,0.0633571648);(117.0340398,0.7120119467);(125.023869,1.665736943);(135.008219,0.0027920489);(143.0133043,0.6439497688);(151.0031336,1.734768415);(159.0446045,0.0075624573);(173.023869,0.0093934653);(177.0187836,0.0021575964);(185.023869,0.008267351);(191.0344337,0.0674332496);(197.023869,0.0076916499);(201.0187836,0.1704133374);(201.0551691,0.0964983948);(215.0344337,0.1131928948);(221.023869,0.002870488);(227.0344337,1.976920862);(239.0344337,0.6926693373);(241.0136983,0.8789003708);(243.0293483,0.9936662251);(251.0344337,1.812829714);(253.0136983,0.091992818);(269.0449984,87.73610005)
Predicted LC-MS/MS	Not Available	Negative	high	View Spectrum	(41.00273965,2.872019279);(49.00782503,1.335852901);(63.0234751,0.5919836545);(65.00273965,2.624088164);(67.01838972,1.401751649);(75.0234751,0.9144555968);(77.00273965,1.78097116);(83.01330434,6.638402059);(87.0234751,0.8893042226);(91.01838972,0.6340676896);(107.0133043,4.038323811);(108.9925689,0.861430115);(117.0340398,13.811108);(125.023869,5.74640456);(143.0133043,2.709244013);(151.0031336,10.95457214);(159.008219,0.789146985);(159.0446045,2.278540139);(173.023869,1.641470014);(185.023869,1.314908337);(197.023869,1.047788894);(201.0187836,2.93211034);(201.0551691,1.751170236);(215.0344337,1.878647534);(227.0344337,9.087682487);(239.0344337,2.764810661);(241.0136983,0.6581759851);(243.0293483,1.426925984);(251.0344337,3.461434622);(253.0136983,1.091206067);(269.0449984,10.0720027)

Food Sources

Name	Group
Celery leaves	Herbs and Spices	Publications	Show
Celery stalks	Vegetables, Other vegetables	Publications	Show
Chamomile tea	Teas and herbal teas	Publications	Show
Common oregano	Herbs and Spices	Publications	Show
Globe artichoke	Vegetables, Other vegetables	Publications	Show
Olive, black	Fruit, Drupes	Publications	Show
Olive, green	Fruit, Drupes	Publications	Show
Parsley	Herbs and Spices	Publications	Show

Food Sources of its Food Phytochemical(s)

Food Phytochemical	Food Source	Food Source Group
Apigenin	Celery leaves	Herbs and Spices	Publications	Show
Apigenin	Celery stalks	Vegetables, Other vegetables	Publications	Show
Apigenin	Chamomile tea	Teas and herbal teas	Publications	Show
Apigenin	Common oregano	Herbs and Spices	Publications	Show
Apigenin	Globe artichoke	Vegetables, Other vegetables	Publications	Show
Apigenin 7-O-glucoside	Globe artichoke	Vegetables, Other vegetables	Publications	Show
Apigenin 7-O-rutinoside	Globe artichoke	Vegetables, Other vegetables	Publications	Show
Apigenin	Olive, black	Fruit, Drupes	Publications	Show
Apigenin 7-O-glucoside	Olive, black	Fruit, Drupes	Publications	Show
Apigenin 7-O-rutinoside	Olive, black	Fruit, Drupes	Publications	Show
Apigenin	Olive, green	Fruit, Drupes	Publications	Show
Apigenin	Parsley	Herbs and Spices	Publications	Show
Apigenin 7-O-rutinoside	Peppermint	Herbs and Spices	Publications	Show
Apigenin 7-O-glucoside	Roman camomile	Herbs and Spices	Publications	Show

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

Food Phytochemical	Metabolite	Species	Biofluids	Origin	TMax	CMax	Urinary Excretion	Formula	Monoisotopic mass
Apigenin	Apigenin	human	urine	unchanged	No data	No data	<1%	C₁₅H₁₀O₅	270.052823422		Publications
Apigenin	Apigenin 7-O-glucuronide	human	plasma, urine	host metabolism	1h-3h	<20nmol/L	<1%	C₂₁H₁₈O₁₁	446.0849114	Detailed Intervention Studies	Publications
Apigenin	Apigenin 4'-O-glucuronide	human	plasma, urine	host metabolism	Not Available	Not Available	<1%	C₂₁H₁₈O₁₁	446.0849114		Publications
Apigenin 7-O-glucoside	Apigenin	human	Not Available	Not Available	Not Available	Not Available	Not Available	C₁₅H₁₀O₅	270.052823422
Apigenin 7-O-rutinoside	Apigenin	human	Not Available	Not Available	Not Available	Not Available	Not Available	C₁₅H₁₀O₅	270.052823422

Inter-Individual Variations in Metabolism

	Food Phytochemical		Metabolite	Effect	Value

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Showing entry for Apigenin