| Spectrum Type | Instrument Type | Ion Mode | Collision Energy Level | View | Peaks |
|---|
| | | | | | |
|---|
| GC-MS | GC-MS | Not Available | Not Available | View Spectrum | (72.0,0.007);(76.0,0.01);(77.0,0.027);(91.0,0.01);(103.0,0.003);(105.0,0.003);(119.0,0.003);(121.0,0.003);(129.0,0.003);(131.0,0.014);(133.0,0.051);(135.0,0.024);(163.0,0.007);(165.0,0.01);(177.0,0.007);(179.0,0.007);(191.0,0.02);(193.0,0.065);(195.0,0.007);(219.0,0.003);(230.0,0.003);(237.0,0.003);(265.0,0.007);(267.0,0.003);(272.0,0.119);(273.0,0.044);(311.0,0.003);(339.0,0.003);(343.0,0.003);(399.0,0.003);(411.0,0.003);(413.0,0.01);(414.0,0.003);(415.0,0.038);(416.0,0.007);(443.0,0.017);(444.0,0.014);(458.0,0.017);(459.0,0.003);(471.0,0.003);(472.0,0.014);(484.0,0.01);(485.0,0.014);(486.0,0.031);(487.0,0.065);(488.0,0.041);(489.0,0.014);(519.0,0.003);(530.0,0.003);(557.0,0.061);(558.0,0.225);(559.0,1.0);(560.0,0.734);(561.0,0.362);(562.0,0.123);(563.0,0.034);(564.0,0.003) | | GC-MS | GC-MS | Not Available | Not Available | View Spectrum | (70.0,0.003);(71.0,0.003);(72.0,0.026);(76.0,0.01);(77.0,0.026);(78.0,0.003);(79.0,0.007);(83.0,0.01);(84.0,0.003);(85.0,0.003);(89.0,0.003);(93.0,0.003);(99.0,0.013);(103.0,0.01);(105.0,0.007);(113.0,0.003);(115.0,0.01);(119.0,0.003);(123.0,0.003);(131.0,0.013);(133.0,0.05);(134.0,0.003);(135.0,0.013);(137.0,0.007);(143.0,0.003);(151.0,0.003);(153.0,0.003);(160.0,0.003);(163.0,0.007);(165.0,0.013);(167.0,0.003);(169.0,0.003);(175.0,0.007);(177.0,0.013);(178.0,0.003);(179.0,0.01);(183.0,0.003);(187.0,0.003);(190.0,0.003);(191.0,0.003);(192.0,0.007);(193.0,0.017);(194.0,0.003);(195.0,0.003);(205.0,0.007);(207.0,0.007);(209.0,0.003);(215.0,0.003);(217.0,0.003);(220.0,0.003);(221.0,0.003);(223.0,0.003);(228.0,0.02);(229.0,0.003);(234.0,0.003);(235.0,0.003);(241.0,0.003);(247.0,0.003);(251.0,0.003);(253.0,0.007);(257.0,0.003);(262.0,0.003);(266.0,0.003);(277.0,0.003);(280.0,0.003);(282.0,0.007);(292.0,0.003);(295.0,0.007);(296.0,0.003);(297.0,0.02);(298.0,0.003);(300.0,0.003);(305.0,0.003);(308.0,0.003);(309.0,0.003);(310.0,0.003);(311.0,0.007);(321.0,0.003);(323.0,0.003);(324.0,0.003);(325.0,0.003);(327.0,0.003);(339.0,0.01);(340.0,0.003);(341.0,0.003);(349.0,0.003);(351.0,0.003);(353.0,0.003);(367.0,0.003);(368.0,0.013);(369.0,0.046);(370.0,0.023);(371.0,0.01);(372.0,0.003);(381.0,0.01);(382.0,0.007);(383.0,0.013);(384.0,0.003);(396.0,0.01);(397.0,0.017);(398.0,0.02);(399.0,0.142);(400.0,0.046);(401.0,0.017);(402.0,0.003);(411.0,0.007);(412.0,0.007);(413.0,0.007);(434.0,0.003);(439.0,0.003);(440.0,0.003);(441.0,0.013);(442.0,0.007);(454.0,0.003);(455.0,0.007);(456.0,0.003);(457.0,0.007);(458.0,0.003);(468.0,0.007);(469.0,0.026);(470.0,0.043);(471.0,0.198);(472.0,0.099);(473.0,0.04);(474.0,0.013);(484.0,0.003);(485.0,0.01);(486.0,0.01);(487.0,0.026);(488.0,0.013);(489.0,0.003);(529.0,0.003);(543.0,0.013);(544.0,0.007);(556.0,0.013);(557.0,0.069);(558.0,0.248);(559.0,1.0);(560.0,0.693);(561.0,0.356);(562.0,0.129);(563.0,0.033);(564.0,0.007);(573.0,0.01);(574.0,0.007);(575.0,0.007) | | GC-MS | GC-MS | Not Available | Not Available | View Spectrum | (72.0,0.007);(76.0,0.01);(77.0,0.027);(91.0,0.01);(103.0,0.003);(105.0,0.003);(119.0,0.003);(121.0,0.003);(129.0,0.003);(131.0,0.014);(133.0,0.051);(135.0,0.024);(163.0,0.007);(165.0,0.01);(177.0,0.007);(179.0,0.007);(191.0,0.02);(193.0,0.065);(195.0,0.007);(219.0,0.003);(230.0,0.003);(237.0,0.003);(265.0,0.007);(267.0,0.003);(272.0,0.119);(273.0,0.044);(311.0,0.003);(339.0,0.003);(343.0,0.003);(399.0,0.003);(411.0,0.003);(413.0,0.01);(414.0,0.003);(415.0,0.038);(416.0,0.007);(443.0,0.017);(444.0,0.014);(458.0,0.017);(459.0,0.003);(471.0,0.003);(472.0,0.014);(484.0,0.01);(485.0,0.014);(486.0,0.031);(487.0,0.065);(488.0,0.041);(489.0,0.014);(519.0,0.003);(530.0,0.003);(557.0,0.061);(558.0,0.225);(559.0,1.0);(560.0,0.734);(561.0,0.362);(562.0,0.123);(563.0,0.034);(564.0,0.003) | | GC-MS | GC-MS | Not Available | Not Available | View Spectrum | (70.0,0.003);(71.0,0.003);(72.0,0.026);(76.0,0.01);(77.0,0.026);(78.0,0.003);(79.0,0.007);(83.0,0.01);(84.0,0.003);(85.0,0.003);(89.0,0.003);(93.0,0.003);(99.0,0.013);(103.0,0.01);(105.0,0.007);(113.0,0.003);(115.0,0.01);(119.0,0.003);(123.0,0.003);(131.0,0.013);(133.0,0.05);(134.0,0.003);(135.0,0.013);(137.0,0.007);(143.0,0.003);(151.0,0.003);(153.0,0.003);(160.0,0.003);(163.0,0.007);(165.0,0.013);(167.0,0.003);(169.0,0.003);(175.0,0.007);(177.0,0.013);(178.0,0.003);(179.0,0.01);(183.0,0.003);(187.0,0.003);(190.0,0.003);(191.0,0.003);(192.0,0.007);(193.0,0.017);(194.0,0.003);(195.0,0.003);(205.0,0.007);(207.0,0.007);(209.0,0.003);(215.0,0.003);(217.0,0.003);(220.0,0.003);(221.0,0.003);(223.0,0.003);(228.0,0.02);(229.0,0.003);(234.0,0.003);(235.0,0.003);(241.0,0.003);(247.0,0.003);(251.0,0.003);(253.0,0.007);(257.0,0.003);(262.0,0.003);(266.0,0.003);(277.0,0.003);(280.0,0.003);(282.0,0.007);(292.0,0.003);(295.0,0.007);(296.0,0.003);(297.0,0.02);(298.0,0.003);(300.0,0.003);(305.0,0.003);(308.0,0.003);(309.0,0.003);(310.0,0.003);(311.0,0.007);(321.0,0.003);(323.0,0.003);(324.0,0.003);(325.0,0.003);(327.0,0.003);(339.0,0.01);(340.0,0.003);(341.0,0.003);(349.0,0.003);(351.0,0.003);(353.0,0.003);(367.0,0.003);(368.0,0.013);(369.0,0.046);(370.0,0.023);(371.0,0.01);(372.0,0.003);(381.0,0.01);(382.0,0.007);(383.0,0.013);(384.0,0.003);(396.0,0.01);(397.0,0.017);(398.0,0.02);(399.0,0.142);(400.0,0.046);(401.0,0.017);(402.0,0.003);(411.0,0.007);(412.0,0.007);(413.0,0.007);(434.0,0.003);(439.0,0.003);(440.0,0.003);(441.0,0.013);(442.0,0.007);(454.0,0.003);(455.0,0.007);(456.0,0.003);(457.0,0.007);(458.0,0.003);(468.0,0.007);(469.0,0.026);(470.0,0.043);(471.0,0.198);(472.0,0.099);(473.0,0.04);(474.0,0.013);(484.0,0.003);(485.0,0.01);(486.0,0.01);(487.0,0.026);(488.0,0.013);(489.0,0.003);(529.0,0.003);(543.0,0.013);(544.0,0.007);(556.0,0.013);(557.0,0.069);(558.0,0.248);(559.0,1.0);(560.0,0.693);(561.0,0.356);(562.0,0.129);(563.0,0.033);(564.0,0.007);(573.0,0.01);(574.0,0.007);(575.0,0.007) | | GC-MS | GC-EI-TOF | positive | Not Available | View Spectrum | (85.0,4.504505);(86.0,1.001001);(87.0,5.005005);(88.0,1.401401);(89.0,3.903904);(90.0,1.401401);(91.0,6.806807);(92.0,1.601602);(93.0,4.204204);(94.0,0.600601);(95.0,1.901902);(96.0,2.602603);(97.0,2.202202);(98.0,1.201201);(99.0,12.212212);(100.0,1.401401);(101.0,2.102102);(102.0,1.501502);(103.0,10.01001);(104.0,1.501502);(105.0,7.207207);(106.0,1.001001);(107.0,4.004004);(108.0,0.600601);(109.0,2.902903);(110.0,0.800801);(111.0,1.301301);(112.0,0.2002);(113.0,1.601602);(114.0,0.500501);(115.0,9.309309);(116.0,1.601602);(117.0,4.604605);(118.0,1.201201);(119.0,7.907908);(120.0,0.800801);(121.0,2.602603);(122.0,0.600601);(123.0,2.402402);(124.0,0.500501);(125.0,1.701702);(126.0,1.001001);(127.0,1.801802);(128.0,1.901902);(129.0,2.702703);(130.0,0.2002);(131.0,13.013013);(132.0,1.901902);(133.0,29.82983);(134.0,3.403403);(135.0,10.610611);(136.0,1.301301);(137.0,6.806807);(138.0,1.101101);(139.0,2.002002);(140.0,0.800801);(141.0,2.002002);(142.0,0.3003);(143.0,2.602603);(144.0,0.3003);(145.0,1.801802);(146.0,0.500501);(147.0,36.736737);(148.0,5.505506);(149.0,6.706707);(150.0,1.601602);(151.0,3.203203);(152.0,1.601602);(153.0,1.701702);(154.0,0.600601);(155.0,1.901902);(156.0,0.3003);(157.0,1.201201);(158.0,0.3003);(159.0,1.201201);(160.0,3.703704);(161.0,4.204204);(162.0,1.601602);(163.0,6.306306);(164.0,1.501502);(165.0,11.011011);(166.0,1.701702);(167.0,2.302302);(168.0,0.800801);(169.0,1.901902);(170.0,1.201201);(171.0,1.101101);(173.0,1.401401);(174.0,0.900901);(175.0,5.205205);(176.0,2.502503);(177.0,7.807808);(178.0,2.802803);(179.0,5.905906);(180.0,1.101101);(181.0,2.102102);(182.0,0.3003);(183.0,3.303303);(184.0,2.102102);(185.0,1.601602);(186.0,0.4004);(187.0,1.601602);(188.0,0.700701);(189.0,3.703704);(190.0,2.902903);(191.0,8.508509);(192.0,3.003003);(193.0,14.114114);(194.0,1.901902);(195.0,3.703704);(196.0,0.4004);(197.0,1.101101);(198.0,1.001001);(199.0,2.002002);(200.0,0.500501);(201.0,0.900901);(202.0,1.701702);(203.0,3.103103);(204.0,0.600601);(205.0,3.703704);(206.0,1.101101);(207.0,11.711712);(208.0,3.403403);(209.0,2.902903);(210.0,1.701702);(211.0,1.101101);(212.0,0.500501);(213.0,2.202202);(214.0,0.800801);(215.0,1.301301);(216.0,0.3003);(217.0,5.405405);(218.0,0.700701);(219.0,2.202202);(220.0,2.202202);(221.0,4.404404);(222.0,1.101101);(223.0,3.703704);(224.0,0.900901);(225.0,3.103103);(226.0,0.600601);(227.0,1.701702);(228.0,8.708709);(229.0,3.303303);(230.0,0.2002);(231.0,0.900901);(232.0,0.3003);(233.0,1.301301);(234.0,1.001001);(235.0,2.502503);(236.0,1.501502);(237.0,2.202202);(238.0,0.600601);(239.0,1.401401);(240.0,1.601602);(241.0,1.901902);(242.0,0.600601);(243.0,0.700701);(245.0,0.3003);(246.0,0.3003);(247.0,2.702703);(248.0,0.600601);(249.0,2.402402);(250.0,0.700701);(251.0,3.603604);(252.0,1.401401);(253.0,3.103103);(254.0,0.500501);(255.0,1.101101);(256.0,0.3003);(257.0,0.700701);(258.0,0.3003);(259.0,1.601602);(260.0,0.600601);(261.0,0.700701);(262.0,0.3003);(263.0,0.700701);(264.0,0.700701);(265.0,2.002002);(266.0,1.901902);(267.0,2.402402);(268.0,1.101101);(269.0,2.202202);(270.0,0.600601);(271.0,0.600601);(272.0,0.600601);(273.0,1.001001);(274.0,0.1001);(275.0,0.3003);(276.0,0.2002);(277.0,1.901902);(278.0,1.101101);(279.0,2.602603);(280.0,1.501502);(281.0,4.804805);(282.0,1.201201);(283.0,1.501502);(284.0,0.2002);(285.0,0.500501);(287.0,0.3003);(289.0,0.4004);(290.0,0.500501);(291.0,1.701702);(292.0,1.101101);(293.0,2.302302);(294.0,1.401401);(295.0,6.406406);(296.0,2.402402);(297.0,8.708709);(298.0,2.502503);(299.0,1.301301);(300.0,0.2002);(301.0,0.4004);(303.0,0.500501);(304.0,0.2002);(305.0,2.102102);(306.0,1.101101);(307.0,1.401401);(308.0,1.101101);(309.0,3.103103);(310.0,1.501502);(311.0,4.404404);(312.0,1.401401);(313.0,0.900901);(314.0,0.1001);(315.0,0.2002);(316.0,0.1001);(317.0,0.2002);(319.0,0.4004);(321.0,1.201201);(322.0,1.301301);(323.0,3.803804);(324.0,4.904905);(325.0,3.303303);(326.0,1.201201);(327.0,1.201201);(328.0,0.4004);(329.0,0.700701);(330.0,0.2002);(331.0,0.700701);(332.0,0.2002);(333.0,0.3003);(334.0,0.1001);(335.0,1.001001);(336.0,0.500501);(337.0,2.402402);(338.0,1.701702);(339.0,4.304304);(340.0,2.502503);(341.0,3.303303);(342.0,1.101101);(343.0,1.001001);(344.0,0.500501);(345.0,0.1001);(347.0,0.1001);(348.0,0.2002);(349.0,0.700701);(350.0,0.4004);(351.0,2.802803);(352.0,1.901902);(353.0,3.403403);(354.0,2.002002);(355.0,2.002002);(356.0,0.600601);(357.0,0.500501);(358.0,0.4004);(361.0,0.2002);(363.0,0.2002);(364.0,0.3003);(365.0,1.501502);(366.0,1.801802);(367.0,3.403403);(368.0,4.404404);(369.0,26.826827);(370.0,12.112112);(371.0,4.304304);(372.0,1.101101);(373.0,0.2002);(374.0,0.1001);(376.0,0.2002);(377.0,0.500501);(378.0,0.700701);(379.0,1.501502);(380.0,1.501502);(381.0,7.407407);(382.0,5.105105);(383.0,8.708709);(384.0,4.204204);(385.0,3.203203);(386.0,0.900901);(387.0,0.500501);(388.0,0.3003);(390.0,0.1001);(391.0,0.2002);(393.0,0.4004);(394.0,0.600601);(395.0,2.902903);(396.0,5.805806);(397.0,7.907908);(398.0,10.710711);(399.0,74.374374);(400.0,32.032032);(401.0,12.912913);(402.0,3.503504);(403.0,1.001001);(405.0,0.1001);(407.0,0.3003);(408.0,0.4004);(409.0,1.601602);(410.0,1.601602);(411.0,5.005005);(412.0,3.003003);(413.0,4.904905);(414.0,2.302302);(415.0,1.701702);(416.0,0.500501);(417.0,0.2002);(422.0,0.2002);(423.0,0.500501);(424.0,0.700701);(425.0,2.002002);(426.0,1.301301);(427.0,1.501502);(428.0,0.900901);(429.0,0.500501);(430.0,0.4004);(433.0,0.1001);(434.0,0.1001);(435.0,0.1001);(436.0,0.1001);(437.0,0.4004);(438.0,0.900901);(439.0,2.802803);(440.0,3.103103);(441.0,9.109109);(442.0,5.405405);(443.0,2.702703);(444.0,0.800801);(445.0,0.3003);(446.0,0.1001);(448.0,0.1001);(449.0,0.2002);(450.0,0.1001);(451.0,0.500501);(452.0,0.1001);(453.0,1.201201);(454.0,1.801802);(455.0,4.504505);(456.0,3.003003);(457.0,3.003003);(458.0,3.203203);(459.0,1.601602);(460.0,0.700701);(461.0,0.2002);(462.0,0.1001);(463.0,0.1001);(464.0,0.1001);(466.0,0.1001);(467.0,0.600601);(468.0,2.502503);(469.0,12.512513);(470.0,27.627628);(471.0,100.0);(472.0,61.661662);(473.0,28.228228);(474.0,9.409409);(475.0,2.602603);(476.0,0.4004);(478.0,0.1001);(479.0,0.1001);(481.0,0.3003);(482.0,0.600601);(483.0,2.302302);(484.0,4.004004);(485.0,6.506507);(486.0,6.906907);(487.0,15.915916);(488.0,11.011011);(489.0,5.705706);(490.0,2.302302);(491.0,0.800801);(496.0,0.1001);(497.0,0.4004);(498.0,0.1001);(499.0,0.3003);(500.0,0.3003) | | Predicted GC-MS | GC-MS | Positive | Not Available | View Spectrum | (108.020578,2.199708278);(109.0284026,1.672280319);(110.0362272,1.837091866);(133.0284026,1.545531264);(134.0362272,2.794631962);(135.0440518,2.040654652);(136.0154921,2.957735072);(150.0311413,3.740630493);(151.0389659,1.994526859);(152.0467905,1.528609249);(160.0154921,1.52909118);(202.0260554,2.240111767);(214.0260554,2.555458803);(215.03388,2.453642812);(216.0417046,3.379843015);(240.0053203,2.259778092);(241.0131449,1.603584523);(242.0209695,4.343263749);(243.0287941,1.67268814);(244.0366187,5.415184694);(245.0444433,3.107179731);(256.0366187,4.890382873);(257.0444433,5.361358116);(258.0522679,8.255219346);(268.0366187,5.588676463);(269.0444433,5.975717219);(270.0158836,1.812800728);(271.0237082,2.060672283);(285.0393574,2.499506251);(286.047182,9.119074501);(287.0505743,1.565365702) | | Predicted GC-MS | GC-MS | Positive | Not Available | View Spectrum | (73.04679982,9.462176448);(115.0573631,2.373549528);(237.0761518,1.4761918);(252.0996256,0.9312928919);(253.1074502,1.577032809);(263.091801,1.828408124);(278.1152748,0.9241451926);(279.0867151,1.308261263);(279.1230994,2.781327303);(281.06598,1.220863053);(289.0710659,1.134290118);(295.1180135,1.431499517);(297.0972784,1.872563586);(305.1023643,1.71792662);(458.1395409,0.962345872);(460.1551901,1.006334496);(473.1630147,1.005051437);(487.1422796,1.728837018);(500.1501042,0.9593908215);(501.1579288,3.796606125);(502.1599776,1.624024903);(502.1657534,4.279674714);(503.1678037,1.831302928);(503.173578,1.858107938);(531.1868893,2.335922257);(532.1887178,1.144859902);(546.2103631,1.051684103);(558.1739788,1.011867928);(559.1818034,6.375679434);(560.1836677,3.198546187);(561.1821431,1.694499879) | | Predicted GC-MS | GC-MS | Ei | Not Available | View Spectrum | (108.020578,1.275153078);(109.0284026,0.8838034948);(133.0284026,1.098541581);(134.0362272,2.578231645);(135.0440518,1.862163338);(136.0154921,4.730070611);(137.0233167,2.008887627);(150.0311413,2.653816181);(151.0389659,1.147780387);(152.0104062,0.9134950692);(152.0467905,0.9283509321);(160.0154921,1.152670262);(202.0260554,0.925005985);(214.0260554,0.8909095894);(215.03388,0.9360328788);(216.0417046,1.304841775);(240.0053203,1.189695536);(241.0131449,0.9296086811);(242.0209695,2.438909867);(243.0287941,0.8891765429);(244.0366187,3.083657864);(245.0444433,1.821609112);(256.0366187,3.311513006);(257.0444433,3.769786925);(258.0522679,5.335702235);(268.0366187,2.941619745);(269.0444433,3.042654131);(270.0158836,1.034307522);(271.0237082,1.301760599);(286.047182,5.497761584);(287.0505743,0.9437369351) | | Predicted GC-MS | GC-MS | Ei | Not Available | View Spectrum | (108.020578,1.275153078);(109.0284026,0.8838034948);(133.0284026,1.098541581);(134.0362272,2.578231645);(135.0440518,1.862163338);(136.0154921,4.730070611);(137.0233167,2.008887627);(150.0311413,2.653816181);(151.0389659,1.147780387);(152.0104062,0.9134950692);(152.0467905,0.9283509321);(160.0154921,1.152670262);(202.0260554,0.925005985);(214.0260554,0.8909095894);(215.03388,0.9360328788);(216.0417046,1.304841775);(240.0053203,1.189695536);(241.0131449,0.9296086811);(242.0209695,2.438909867);(243.0287941,0.8891765429);(244.0366187,3.083657864);(245.0444433,1.821609112);(256.0366187,3.311513006);(257.0444433,3.769786925);(258.0522679,5.335702235);(268.0366187,2.941619745);(269.0444433,3.042654131);(270.0158836,1.034307522);(271.0237082,1.301760599);(286.047182,5.497761584);(287.0505743,0.9437369351) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Positive | Not Available | View Spectrum | (257.0596,0.024024024);(285.0555,0.032032032);(286.1532,0.013013013);(287.0621,1.0);(288.0658,0.1421421421);(289.0284,0.04004004);(626.0334,0.0550550551);(627.0405,0.014014014);(629.1605,0.011011011) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Negative | Not Available | View Spectrum | (65.0013,0.011011011);(83.0129,0.011011011);(105.0341,0.011011011);(107.0137,0.038038038);(121.0296,0.012012012);(132.0216,0.045045045);(133.0294,0.3263263263);(134.0333,0.013013013);(149.0244,0.029029029);(151.0038,0.0750750751);(175.0403,0.044044044);(199.0405,0.036036036);(201.0195,0.016016016);(217.0508,0.022022022);(241.0504,0.014014014);(243.0303,0.01001001);(285.0399,1.0);(285.2979,0.026026026);(285.5068,0.012012012);(285.6699,0.01001001);(285.7968,0.01001001);(286.0444,0.0720720721) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Positive | Not Available | View Spectrum | (67.0076,0.0790790791);(68.9873,0.0800800801);(69.027,0.02002002);(79.0465,0.02002002);(89.0325,0.0910910911);(107.0455,0.031031031);(109.0251,0.026026026);(111.0041,0.03003003);(115.0518,0.021021021);(117.0308,0.1341341341);(128.0605,0.022022022);(135.0428,0.3493493493);(135.1027,0.036036036);(137.0222,0.1121121121);(139.0536,0.04004004);(153.0178,1.0);(153.0816,0.1031031031);(154.0207,0.026026026);(157.0644,0.033033033);(161.0233,0.1431431431);(171.0444,0.034034034);(179.0339,0.042042042);(185.0604,0.041041041);(203.0351,0.021021021);(213.0561,0.0570570571);(241.0502,0.1511511512);(269.0452,0.0590590591);(287.0556,0.6826826827);(287.1415,0.044044044);(288.059,0.042042042) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Positive | Not Available | View Spectrum | (67.0073,0.013013013);(68.9873,0.02002002);(89.0329,0.032032032);(117.0311,0.017017017);(135.0431,0.039039039);(137.0221,0.016016016);(139.0531,0.012012012);(153.0182,0.1441441441);(153.0814,0.01001001);(161.0235,0.024024024);(241.051,0.018018018);(287.0556,1.0);(287.1414,0.0550550551);(288.0596,0.0660660661) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Positive | Not Available | View Spectrum | (153.0199,0.1931931932);(287.0555,1.0) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Positive | Not Available | View Spectrum | (67.0193,0.1271271271);(68.9974,0.1321321321);(89.0394,0.1411411411);(117.0346,0.1721721722);(135.0449,0.3713713714);(137.024,0.1301301301);(153.0186,1.0);(161.0244,0.1541541542);(241.0493,0.1361361361);(287.0555,0.4704704705) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Negative | Not Available | View Spectrum | (107.0141,0.0640640641);(132.0227,0.0600600601);(133.0294,0.4734734735);(151.0033,0.0930930931);(175.0399,0.0580580581);(285.0399,1.0) | | LC-MS/MS | LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) | Negative | Not Available | View Spectrum | (63.0246,0.02002002);(65.0044,0.0630630631);(83.0138,0.0550550551);(105.0345,0.029029029);(107.0139,0.1451451451);(121.0287,0.046046046);(132.0204,0.0610610611);(133.0282,1.0);(143.0498,0.016016016);(145.0287,0.015015015);(147.0435,0.013013013);(149.0236,0.0520520521);(151.0021,0.0930930931);(171.0441,0.018018018);(174.03,0.011011011);(175.0391,0.0720720721);(198.0315,0.018018018);(199.0384,0.039039039);(201.0176,0.028028028);(215.0341,0.014014014);(217.0483,0.013013013);(285.0399,0.022022022) | | LC-MS/MS | LC-ESI-ITTOF (LCMS-IT-TOF) | Positive | Not Available | View Spectrum | (267.1888,0.003003003);(287.0539,1.0);(287.2167,0.018018018);(287.3959,0.019019019);(287.5751,0.01001001);(288.0642,0.1601601602);(289.0599,0.023023023);(391.2636,0.003003003);(571.0981,0.014014014);(597.0613,0.003003003);(623.9857,0.003003003);(625.0183,0.004004004);(626.0277,0.041041041);(627.0139,0.015015015);(628.0009,0.009009009);(879.6364,0.003003003);(1733.6567,0.003003003) | | LC-MS/MS | LC-ESI-ITTOF (LCMS-IT-TOF) | Negative | Not Available | View Spectrum | (285.0329,1.0);(285.1952,0.018018018);(285.3412,0.021021021);(285.5523,0.006006006);(286.0397,0.1831831832);(287.0482,0.018018018);(399.0314,0.1091091091);(400.0302,0.035035035);(553.0446,0.01001001);(569.0682,0.03003003);(570.0773,0.014014014);(571.0873,0.7257257257);(571.317,0.012012012);(571.5007,0.014014014);(571.8224,0.01001001);(572.0982,0.2522522523);(573.0869,0.046046046);(574.0765,0.006006006);(593.0647,0.006006006);(623.9973,0.014014014);(625.0059,0.007007007);(791.3502,0.006006006);(910.0342,0.006006006) | | LC-MS/MS | ESI-TOF | Negative | Not Available | View Spectrum | (255.0295,187.0);(256.0326,23.0);(257.0421,6.0);(283.0243,481.0);(284.0276,66.0);(285.04,999.0);(286.0431,129.0);(287.0447,14.0);(299.0193,2.0);(301.0343,16.0);(302.0377,3.0);(384.9627,2.0) | | LC-MS/MS | ESI-TOF | Negative | Not Available | View Spectrum | (107.0173,43.0);(133.0331,80.0);(139.0556,10.0);(149.0287,20.0);(151.0077,40.0);(159.0464,10.0);(169.0226,9.0);(173.0642,8.0);(175.0438,24.0);(183.0467,28.0);(198.0398,9.0);(201.0306,9.0);(217.0573,24.0);(223.0472,10.0);(226.0361,10.0);(227.041,27.0);(229.0567,10.0);(241.0583,12.0);(243.0381,25.0);(255.0371,999.0);(256.0398,135.0);(257.0464,29.0);(267.0384,9.0);(283.0247,10.0);(285.0482,239.0);(286.0531,24.0) | | LC-MS/MS | ESI-TOF | Negative | Not Available | View Spectrum | (255.0295,187.0);(256.0326,23.0);(257.0421,6.0);(283.0243,481.0);(284.0276,66.0);(285.04,999.0);(286.0431,129.0);(287.0447,14.0);(299.0193,2.0);(301.0343,16.0);(302.0377,3.0);(384.9627,2.0) | | LC-MS/MS | ESI-TOF | Negative | Not Available | View Spectrum | (107.0173,43.0);(133.0331,80.0);(139.0556,10.0);(149.0287,20.0);(151.0077,40.0);(159.0464,10.0);(169.0226,9.0);(173.0642,8.0);(175.0438,24.0);(183.0467,28.0);(198.0398,9.0);(201.0306,9.0);(217.0573,24.0);(223.0472,10.0);(226.0361,10.0);(227.041,27.0);(229.0567,10.0);(241.0583,12.0);(243.0381,25.0);(255.0371,999.0);(256.0398,135.0);(257.0464,29.0);(267.0384,9.0);(283.0247,10.0);(285.0482,239.0);(286.0531,24.0) | | LC-MS/MS | DI-ESI-qTof | Negative | Not Available | View Spectrum | (121.026863,550.0);(132.018921,1232.0);(133.026459,26027.0);(134.030975,1441.0);(143.047058,273.0);(147.043503,244.0);(149.020935,4430.0);(151.000275,13582.0);(152.003326,714.0);(157.062988,249.0);(169.011047,657.0);(171.042068,915.0);(173.054153,368.0);(174.163895,284.0);(175.03569,7354.0);(176.039658,528.0);(177.017105,409.0);(185.056351,872.0);(187.035095,263.0);(189.050095,588.0);(195.043015,223.0);(196.048767,222.0);(197.056488,898.0);(198.029572,1085.0);(199.035767,6254.0);(200.041687,564.0);(201.015457,3054.0);(202.110214,302.0);(211.036942,538.0);(212.041687,420.0);(213.050873,1557.0);(214.031677,305.0);(215.031784,1601.0);(217.045349,4658.0);(218.048386,365.0);(223.036621,811.0);(224.044373,261.0);(226.022156,389.0);(229.044403,1012.0);(239.028534,629.0);(240.035416,485.0);(241.045868,2742.0);(242.020813,423.0);(243.026535,1888.0);(257.039612,1485.0);(258.044769,186.0);(267.024719,1280.0);(285.034851,55286.0) | | LC-MS/MS | DI-ESI-qTof | Positive | Not Available | View Spectrum | (115.051262,504.0);(117.031013,641.0);(125.01973,245.0);(127.05172,176.0);(128.059174,1164.0);(129.065811,555.0);(131.047424,217.0);(135.039627,5869.0);(136.044647,296.0);(137.019653,2430.0);(139.050491,2146.0);(143.0448,377.0);(145.060043,519.0);(147.040085,498.0);(153.014969,22833.0);(154.017624,1034.0);(155.052673,614.0);(157.061218,1310.0);(161.017838,5152.0);(162.020218,333.0);(163.033463,177.0);(167.043716,532.0);(168.053513,220.0);(171.031128,2669.0);(172.037918,201.0);(173.054291,177.0);(179.028397,789.0);(184.047455,341.0);(185.052246,1457.0);(187.034576,187.0);(195.041046,703.0);(199.032883,349.0);(203.027924,469.0);(212.041077,391.0);(213.049652,2134.0);(214.052475,188.0);(216.038834,247.0);(219.060623,166.0);(223.031113,225.0);(229.044113,264.0);(231.059509,189.0);(240.037323,346.0);(241.043793,3934.0);(242.049896,409.0);(244.033646,472.0);(245.038681,267.0);(258.046936,505.0);(259.050201,195.0);(269.03952,1409.0);(287.045502,11938.0) | | LC-MS/MS | LC-ESI-QTOF | negative | Not Available | View Spectrum | (65.0013,1.171171);(83.0129,1.124458);(105.0341,1.187855);(107.0137,3.830497);(121.0296,1.227895);(132.0216,4.557891);(133.0294,32.676009);(134.0333,1.317985);(149.0244,2.979646);(151.0038,7.530864);(175.0403,4.404404);(199.0405,3.680347);(201.0195,1.651652);(217.0508,2.222222);(241.0504,1.431431);(243.0303,1.097764);(285.0399,100.0);(285.2979,2.609276);(285.5068,1.267935);(285.6699,1.071071);(285.7968,1.031031);(286.0444,7.243911) | | LC-MS/MS | LC-ESI-QTOF | negative | Not Available | View Spectrum | (107.0141,6.443089);(132.0227,5.992683);(133.0294,47.325203);(151.0033,9.260163);(175.0399,5.795122);(285.0399,100.0) | | LC-MS/MS | LC-ESI-QTOF | negative | Not Available | View Spectrum | (63.0246,2.016752);(65.0044,6.348871);(83.0138,5.522214);(105.0345,2.931537);(107.0139,14.508376);(121.0287,4.631464);(132.0204,6.09614);(133.0282,100.0);(143.0498,1.556446);(145.0287,1.498908);(147.0435,1.29716);(149.0236,5.216315);(151.0021,9.337218);(171.0441,1.841952);(174.03,1.099782);(175.0391,7.230153);(198.0315,1.774945);(199.0384,3.898034);(201.0176,2.771304);(215.0341,1.353241);(217.0483,1.27968);(285.0399,2.17917) | | LC-MS/MS | LC-ESI-QTOF | negative | Not Available | View Spectrum | (133.0282,1.355745);(151.0049,0.595205);(256.0361,1.162855);(257.0327,0.501516);(284.0311,1.388812);(284.2706,0.551116);(285.04,100.0) | | LC-MS/MS | LC-ESI-QTOF | negative | Not Available | View Spectrum | (107.0138,1.351559);(133.0288,7.03425);(149.0248,2.019659);(151.0028,5.421594);(175.0397,3.647673);(197.0613,0.929197);(198.0336,0.821686);(199.0414,2.910459);(201.0198,0.790969);(213.0586,1.075104);(215.0376,0.913838);(217.0495,2.45738);(241.0509,1.927507);(243.0288,1.34388);(256.0324,2.442021);(257.0378,1.612656);(285.0398,100.0) | | LC-MS/MS | LC-ESI-QTOF | negative | Not Available | View Spectrum | (104.0275,0.718085);(105.0346,3.909574);(107.0136,13.922872);(115.0166,0.531915);(115.0544,0.558511);(117.0331,1.077128);(121.029,4.667553);(132.021,8.457447);(133.0291,100.0);(133.0632,1.635638);(133.0804,1.43617);(133.112,0.545213);(133.1366,1.50266);(143.0474,0.87766);(145.0314,1.781915);(146.0388,0.691489);(147.0475,0.944149);(149.0251,4.268617);(151.0026,6.861702);(167.0507,0.744681);(169.0283,0.87766);(171.0424,0.757979);(173.0258,1.236702);(174.0296,1.037234);(175.0402,7.593085);(182.036,1.06383);(183.0574,0.598404);(185.0553,0.851064);(187.04,0.930851);(195.0467,0.718085);(197.0227,1.010638);(198.0341,2.340426);(199.038,3.49734);(201.0197,2.965426);(211.0378,1.023936);(214.0221,0.718085);(215.0341,1.010638);(217.0487,0.824468);(223.0412,0.664894);(229.0493,0.518617);(239.0378,0.797872);(242.0196,0.664894);(255.032,0.558511);(256.0379,0.651596);(285.04,1.609043) | | LC-MS/MS | Linear Ion Trap | negative | Not Available | View Spectrum | (106.913663,1.985474);(132.951673,3.85984);(142.986623,0.557769);(148.951128,4.505464);(150.928074,22.240987);(151.950053,0.686804);(154.969701,0.774645);(156.984053,0.510231);(168.993254,3.992823);(170.999722,4.528844);(172.999178,1.900029);(174.986467,64.757171);(175.982095,3.016943);(176.954068,1.011556);(185.004759,3.876153);(188.995507,1.562939);(195.024979,1.650085);(196.03443,0.79438);(197.02828,18.481004);(197.986971,10.260181);(198.993896,66.547949);(200.01612,3.270335);(201.005006,19.579364);(201.953394,0.744772);(211.003962,1.340358);(212.022267,2.774319);(213.03855,18.925706);(213.996548,1.737339);(215.019864,5.753439);(217.011261,55.908799);(218.013747,2.985467);(223.005247,9.902232);(224.034912,1.800895);(225.980879,5.512714);(226.995729,0.575923);(229.044043,3.294503);(239.001261,4.502126);(240.039918,4.088674);(241.040981,100.0);(242.043046,12.039769);(243.006006,61.461747);(243.983304,3.625222);(257.013026,19.778149);(258.047804,1.312108);(267.015937,13.728697);(268.069481,1.472598);(285.033006,51.266757);(286.058802,3.977824) | | LC-MS/MS | Linear Ion Trap | negative | Not Available | View Spectrum | (106.91291,1.921713);(132.958116,4.465112);(142.993654,0.725355);(148.958742,4.822786);(150.94861,24.154331);(151.965316,0.777943);(154.978998,1.071831);(156.983849,0.629459);(169.000637,4.181334);(171.021072,4.485619);(173.023982,2.094988);(174.984198,62.237573);(175.961181,3.007611);(176.922526,0.877935);(185.003643,3.841787);(189.000872,1.865838);(195.012071,1.651832);(196.013338,0.778951);(197.018319,17.594459);(197.994187,10.783446);(198.994558,66.485748);(200.016466,3.883523);(201.003222,18.349013);(201.987506,0.878576);(211.03855,1.430751);(212.027737,2.874446);(213.035191,19.561836);(214.029762,1.598464);(214.999515,6.103693);(217.003165,56.362938);(217.993182,3.435247);(223.020074,9.988624);(224.022264,1.67508);(225.994958,6.253176);(227.006197,0.717768);(229.025732,3.539557);(239.015987,4.40588);(240.031705,4.418248);(241.053795,100.0);(242.042886,13.008036);(242.995098,61.578064);(244.001544,4.093252);(257.035644,19.793095);(258.035229,1.405793);(267.040894,14.891395);(268.047924,1.496918);(285.051147,58.668944);(286.066123,4.476425) | | LC-MS/MS | Linear Ion Trap | negative | Not Available | View Spectrum | (106.986984,1.721707);(132.994603,4.078626);(149.023863,4.458276);(150.995472,21.628424);(155.045907,0.589278);(169.082231,3.580684);(171.055379,4.256189);(173.069074,1.798971);(175.052491,61.751665);(176.062428,1.621752);(177.004601,0.664386);(185.068134,3.248036);(186.973064,0.621735);(189.069589,1.387221);(195.052769,1.240191);(197.075225,17.140049);(198.042655,8.185383);(199.057875,61.212956);(200.072201,1.40045);(201.029705,17.168341);(211.042111,1.091052);(212.058982,2.651623);(213.072104,18.645916);(214.060567,0.927689);(215.066016,5.530647);(217.06605,53.853395);(218.054526,1.332956);(223.057991,9.799234);(224.067415,0.919456);(226.028912,5.734917);(229.075368,3.154734);(239.059922,4.26679);(240.063378,3.80607);(241.065119,100.0);(242.052071,9.837347);(243.047786,60.54787);(244.058703,1.95264);(256.051763,5.441377);(257.065325,21.279161);(258.065415,0.502775);(267.046277,13.218094);(268.056027,1.043589);(269.056689,0.68502);(285.049868,11.174454) | | LC-MS/MS | Linear Ion Trap | negative | Not Available | View Spectrum | (223.123239,1.037542);(224.068697,0.590169);(239.052012,100.0);(240.048054,4.087403);(252.057838,1.033921) | | LC-MS/MS | LC-ESI-TOF | negative | Not Available | View Spectrum | (107.0173,4.304304);(133.0331,8.008008);(139.0556,1.001001);(149.0287,2.002002);(151.0077,4.004004);(159.0464,1.001001);(169.0226,0.900901);(173.0642,0.800801);(175.0438,2.402402);(183.0467,2.802803);(198.0398,0.900901);(201.0306,0.900901);(217.0573,2.402402);(223.0472,1.001001);(226.0361,1.001001);(227.041,2.702703);(229.0567,1.001001);(241.0583,1.201201);(243.0381,2.502503);(255.0371,100.0);(256.0398,13.513514);(257.0464,2.902903);(267.0384,0.900901);(283.0247,1.001001);(285.0482,23.923924);(286.0531,2.402402) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (287.056,100.0);(288.062,3.36206) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (153.02,1.08118);(287.056,100.0);(288.062,4.66012) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (67.018,2.57309);(68.996,1.98486);(89.038,1.6187);(107.048,1.23989);(111.007,2.33672);(117.032,5.64586);(125.02,1.04437);(135.043,24.03069);(137.023,7.373);(139.054,1.29173);(153.018,77.35849);(154.022,1.78457);(157.065,1.48041);(161.026,9.04624);(171.042,2.26415);(179.039,3.58905);(185.065,2.16255);(203.04,1.57412);(213.059,3.23865);(231.067,1.18122);(241.054,11.39125);(245.049,1.62347);(269.048,4.86212);(287.055,100.0);(288.06,5.18764) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (55.019,1.67805);(63.023,0.90146);(67.018,20.25756);(68.997,29.9944);(77.039,3.90705);(79.055,4.26764);(81.035,2.80683);(83.014,1.51904);(87.022,0.99104);(89.039,31.01344);(91.054,0.95633);(97.03,3.72788);(103.054,0.93673);(105.035,1.9972);(107.049,3.53471);(109.027,2.58679);(111.008,3.57055);(115.053,11.43897);(117.033,24.49608);(121.029,1.06215);(125.024,3.62094);(127.049,4.66573);(128.06,12.61478);(129.066,5.1047);(131.048,1.61926);(133.027,1.96361);(135.043,25.15677);(137.025,17.80515);(139.054,19.73124);(143.045,2.66349);(145.062,2.61646);(147.042,2.57559);(153.018,100.0);(154.023,2.84826);(155.056,3.64894);(157.065,5.95745);(161.026,26.45017);(167.053,2.84826);(168.06,1.17973);(171.047,6.73012);(179.04,1.36226);(184.058,2.10358);(185.064,4.79115);(187.044,1.1467);(195.048,2.53919);(203.038,1.03583);(212.05,3.42553);(213.059,4.82643);(229.052,1.56775);(240.044,1.64334);(241.054,7.43561);(287.055,4.64894) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (67.0076,7.920918);(68.9873,8.09949);(69.027,2.015306);(79.0465,2.072704);(89.0325,9.202806);(107.0455,3.182398);(109.0251,2.665816);(111.0041,3.029337);(115.0518,2.149235);(117.0308,13.4375);(128.0605,2.206633);(135.0428,34.961735);(135.1027,3.622449);(137.0222,11.218112);(139.0536,4.049745);(153.0178,100.0);(153.0816,10.408163);(154.0207,2.659439);(157.0644,3.392857);(161.0233,14.394133);(171.0444,3.469388);(179.0339,4.292092);(185.0604,4.139031);(203.0351,2.149235);(213.0561,5.803571);(241.0502,15.210459);(269.0452,5.956633);(287.0556,68.303571);(287.1415,4.457908);(288.059,4.266582) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (67.0073,1.31638);(68.9873,2.030666);(89.0329,3.29095);(117.0311,1.71279);(135.0431,3.982797);(137.0221,1.611818);(139.0531,1.293942);(153.0182,14.454001);(153.0814,1.05086);(161.0235,2.449514);(241.051,1.806283);(287.0556,100.0);(287.1414,5.579656);(288.0596,6.641735) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (153.0199,19.302949);(287.0555,100.0) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (67.0193,12.736027);(68.9974,13.207034);(89.0394,14.098807);(117.0346,17.220013);(135.0449,37.094411);(137.024,13.010257);(153.0186,100.0);(161.0244,15.407159);(241.0493,13.623613);(287.0555,47.016956) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (161.0196,2.337938);(287.0548,100.0) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (135.0461,4.656319);(153.0196,5.986696);(161.0246,2.217295);(241.0468,2.993348);(287.0541,100.0) | | LC-MS/MS | LC-ESI-QTOF | positive | Not Available | View Spectrum | (117.0322,52.317881);(135.04,44.370861);(153.0183,100.0);(157.0619,14.569536);(241.0438,18.543046);(287.0508,30.463576) | | LC-MS/MS | Linear Ion Trap | positive | Not Available | View Spectrum | (134.890448,3.775226);(136.884282,2.706832);(152.917944,38.044909);(153.873494,3.052072);(160.924195,4.610422);(178.976941,2.759961);(189.011404,0.853997);(198.937494,0.971677);(201.018613,1.42806);(202.970307,2.146733);(212.935138,0.685502);(217.083338,0.74899);(219.023029,2.84445);(220.083338,0.503914);(226.952087,1.516397);(231.033398,1.910749);(241.040757,5.18069);(241.987508,1.391473);(245.002622,8.429928);(246.049222,1.210849);(259.008187,3.702472);(260.166672,0.597782);(262.986762,0.673315);(269.034668,4.628341);(270.038997,0.876543);(287.063198,100.0);(288.056178,17.087629) | | LC-MS/MS | Linear Ion Trap | positive | Not Available | View Spectrum | (108.916668,0.554233);(134.933707,5.018411);(136.871221,2.91807);(152.931603,41.395299);(153.916669,2.86214);(160.947334,6.047022);(162.083336,0.508254);(176.901342,0.549356);(178.927368,2.759584);(188.93583,0.690857);(199.000664,1.025828);(201.025372,1.103833);(202.962949,1.652633);(216.925115,0.630565);(219.002167,3.009178);(226.992581,1.654609);(230.987797,1.821871);(240.984524,6.917468);(241.916672,0.787958);(242.166672,0.615918);(244.980784,7.833776);(245.750005,0.666508);(246.000005,0.82041);(259.033011,4.197195);(259.666672,0.509536);(259.916672,0.551119);(260.250006,0.697978);(263.083339,0.586903);(269.021536,4.651939);(269.750006,0.53781);(270.083339,0.617598);(287.062086,100.0);(287.986759,13.52312) | | LC-MS/MS | Linear Ion Trap | positive | Not Available | View Spectrum | (134.898797,4.490085);(136.895473,3.281953);(152.900065,46.973585);(153.924982,3.15602);(160.91087,6.565002);(162.083336,0.617493);(173.018481,0.514336);(178.970738,2.015781);(182.840187,0.533498);(188.91667,0.583371);(198.858603,1.301888);(200.991732,2.028603);(202.977012,2.538828);(213.083338,0.668565);(216.939486,0.798083);(219.007691,3.012986);(226.750005,1.177254);(227.000005,1.197824);(231.010451,3.105078);(240.992656,7.79757);(241.955071,1.16078);(244.987385,9.02521);(246.000005,0.666589);(246.250005,0.726602);(259.027884,4.088904);(260.166672,0.555435);(262.965414,0.779836);(269.056681,5.680627);(270.099235,0.726733);(287.063654,100.0);(288.041644,12.958794) | | LC-MS/MS | Linear Ion Trap | positive | Not Available | View Spectrum | (124.926973,0.600582);(134.942103,4.7895);(135.916669,0.552504);(136.894511,3.703532);(152.90825,45.968284);(153.920623,3.254277);(160.909293,6.298023);(161.833336,0.696649);(178.934405,3.133239);(189.000004,0.738602);(198.916991,1.005597);(201.063912,1.864439);(202.976744,2.392789);(213.083338,0.514212);(216.833338,0.637525);(218.990415,2.618043);(226.932049,1.205862);(230.997339,2.476646);(232.083338,0.517793);(241.012296,6.857409);(242.02953,0.97753);(244.999621,7.926932);(245.980366,1.837941);(259.040179,4.296203);(260.166672,1.194481);(263.083339,0.692523);(269.000212,4.541733);(270.166673,0.930349);(287.037584,100.0);(288.032934,11.89658) | | LC-MS/MS | Linear Ion Trap | positive | Not Available | View Spectrum | (108.938358,0.725474);(110.956731,0.880865);(116.974752,0.745019);(135.001244,9.439355);(136.985933,7.043899);(152.983438,100.0);(153.978487,2.91364);(161.005298,13.625517);(161.988797,0.566679);(173.033331,0.646992);(177.009168,1.537825);(179.020566,5.46081);(183.032347,0.913161);(185.040277,0.549);(189.023883,1.771928);(199.02702,2.038609);(201.039691,3.28505);(203.037044,4.228165);(213.044754,1.186949);(217.044498,1.382347);(218.043066,0.546233);(219.070524,6.297594);(227.01207,3.013495);(231.044627,4.226843);(241.051327,14.722086);(242.056088,1.047732);(245.047305,19.804195);(246.037782,1.250583);(248.047544,0.667522);(258.059508,2.885311);(259.076661,9.058068);(263.052578,1.036692);(268.080332,3.180894);(269.053626,10.8124);(270.048386,1.848728);(271.056075,0.511666);(287.075342,48.484086);(288.072101,2.980855) | | LC-MS/MS | Linear Ion Trap | positive | Not Available | View Spectrum | (152.974094,15.315292);(153.973269,0.822352);(192.980023,0.433281);(195.057702,0.24622);(201.987753,1.756949);(203.018485,0.288184);(212.042511,0.551315);(213.019669,0.886419);(215.02663,0.346479);(215.995686,0.230287);(217.040309,0.246526);(219.006433,0.874168);(220.978031,0.877408);(222.967317,0.651618);(224.028175,0.326183);(229.068107,0.234595);(230.074928,0.230064);(231.083338,0.271212);(237.022324,0.270454);(238.938026,0.559417);(240.056738,0.387288);(242.051195,0.443251);(243.053316,0.501329);(244.018141,1.41895);(245.026844,1.601841);(247.149287,0.380545);(255.0668,0.512796);(255.844105,0.263634);(257.025025,0.690595);(258.055177,1.557824);(259.026655,1.289787);(261.049385,0.330448);(263.017173,0.809777);(268.045316,4.216048);(269.044834,1.590056);(270.019532,0.366569);(271.043749,0.369001);(273.057886,1.432954);(276.098508,0.26832);(277.074999,1.006028);(282.266224,0.738712);(283.051896,1.39314);(285.006683,2.440256);(286.042769,33.246546);(287.01854,21.670109);(288.000006,0.475678);(289.064423,1.292938);(291.053883,0.284586);(298.049079,0.382754);(299.116972,0.282948);(300.016037,0.438359);(301.034673,4.81643);(302.062348,13.89371);(303.063892,1.206244);(304.014707,0.35158);(305.058704,1.23106);(306.183242,0.613535);(307.013691,0.475336);(309.137653,0.308474);(315.056947,0.529068);(317.029231,5.214093);(318.046167,0.29179);(319.057748,2.822951);(320.098118,0.32469);(321.091353,0.739891);(323.073259,0.920349);(324.08334,0.254759);(325.500007,0.823307);(326.08334,1.062819);(326.58334,0.394618);(329.021247,1.055269);(330.035335,0.244426);(332.083341,0.460174);(333.068305,16.169336);(334.121688,0.247943);(335.071783,0.495447);(337.068589,0.553301);(346.250008,0.329828);(347.055821,42.39672);(348.011392,0.607672);(349.087611,1.125351);(350.052816,1.817205);(364.129842,0.588611);(365.007948,0.877129) | | LC-MS/MS | Not Available | positive | Not Available | View Spectrum | (115.048271,0.101155);(117.032135,0.259863);(125.023422,0.076738);(128.060165,0.184869);(129.059235,0.132547);(133.027725,0.076738);(135.042496,1.609753);(136.04631,0.202309);(137.021317,1.135373);(138.023499,0.088946);(139.054169,0.397642);(145.037796,0.085458);(153.016693,10.35439);(154.020325,1.299313);(155.045349,0.109875);(157.059799,0.113363);(161.02243,1.171998);(167.048599,0.143012);(168.057037,0.078482);(171.036499,0.343577);(175.0383,0.080226);(179.031982,0.352297);(184.052933,0.085458);(185.060089,0.174404);(189.052521,0.092434);(195.042938,0.151732);(199.038788,0.183125);(203.033997,0.324392);(212.047806,0.170916);(213.053589,0.690641);(214.058289,0.136035);(217.04332,0.076738);(219.065857,0.099411);(227.027161,0.130803);(229.03714,0.07325);(231.056915,0.099411);(240.047287,0.097666);(241.049789,1.369075);(242.054993,0.247654);(245.041306,0.204053);(258.045258,0.193589);(259.05426,0.094178);(263.050323,0.144756);(269.042542,1.187694);(270.044617,0.362761);(285.744659,0.092434);(286.047363,0.200565);(286.937225,0.286023);(287.055847,100.0);(287.302551,0.088946);(287.411163,0.111619);(287.812317,0.149988);(288.058167,18.448498);(288.643494,0.078482);(289.059601,2.166103);(290.064301,0.218006) | | LC-MS/MS | Not Available | positive | Not Available | View Spectrum | (153.018417,1.026561);(161.024765,0.576521);(203.040131,0.455923);(241.049561,0.732418);(245.043182,0.370621);(269.04364,1.029503);(287.02002,0.338265);(287.057281,100.0);(287.159332,0.350031);(287.611084,1.63838);(288.058746,1.664853);(604.343018,0.120599);(794.422119,0.10295) | | LC-MS/MS | Not Available | positive | Not Available | View Spectrum | (76.112946,0.038126);(77.040588,0.075305);(77.063637,0.036705);(78.044754,0.027233);(79.053299,0.385048);(80.06427,0.040731);(80.658485,0.021076);(81.034111,0.150372);(83.000809,0.037652);(83.014641,0.073647);(85.027687,0.088803);(86.35276,0.027233);(86.503098,0.051624);(87.022316,0.11793);(87.794647,0.02747);(89.038025,2.269084);(89.930786,0.030548);(90.010788,0.053518);(90.042297,0.050203);(90.639725,0.05044);(91.021233,0.065832);(91.048691,0.040968);(93.034752,0.06228);(95.049072,0.086671);(97.029289,0.538972);(97.142998,0.020602);(97.217216,0.042152);(98.77211,0.017761);(101.038689,0.046177);(104.140015,0.079567);(104.162971,0.042388);(105.045486,0.327978);(105.137077,0.053992);(105.656708,0.029601);(106.048447,0.048782);(106.345764,0.086435);(107.047943,0.295298);(108.055038,0.041204);(108.799744,0.066306);(109.028893,0.215968);(109.059105,0.042625);(109.100479,0.034574);(109.48848,0.019655);(109.630508,0.053518);(111.007103,0.449696);(111.042839,0.125744);(111.632874,0.037415);(112.008698,0.052571);(112.986305,0.10159);(115.034904,0.085961);(115.052917,0.456801);(115.324463,0.073173);(116.058228,0.070805);(116.398544,0.022023);(116.95826,0.036942);(117.032707,1.8748);(117.06916,0.12314);(118.823265,0.016576);(119.010963,0.095433);(119.043198,0.0341);(119.39344,0.036705);(121.027176,0.0386);(123.040672,0.10159);(123.834152,0.065832);(124.288284,0.033153);(125.022423,0.33816);(126.027512,0.120298);(127.036789,0.081225);(127.412125,0.052808);(128.039246,0.03339);(128.062195,0.412991);(129.018188,0.214073);(129.04068,0.047125);(129.067993,0.40494);(130.046997,0.039784);(130.723663,0.046414);(131.048874,0.157713);(133.021667,0.040731);(133.060898,0.088092);(133.753174,0.087619);(133.991409,0.054229);(134.037704,0.044993);(134.906113,0.056123);(135.013397,0.217862);(135.043381,5.310868);(136.046295,0.449696);(137.023438,2.458766);(137.125778,0.029364);(137.178772,0.029127);(138.029053,0.111773);(139.053925,1.058527);(140.059143,0.337213);(141.030151,0.040494);(141.068054,0.145399);(143.002487,0.041441);(143.048798,0.199391);(144.00824,0.031022);(144.056671,0.057544);(145.022736,0.042152);(145.040146,0.08975);(145.06601,0.119587);(146.020432,0.046651);(146.06926,0.029127);(147.043289,0.334135);(148.083618,0.045467);(149.04184,0.054939);(149.439423,0.054466);(149.696075,0.052808);(150.036392,0.13427);(151.036179,0.171448);(152.012802,0.075541);(152.130569,0.025812);(152.648926,0.029838);(152.803223,0.033863);(152.968292,0.042152);(153.017654,16.766639);(153.151932,0.028654);(153.191086,0.02226);(153.271591,0.034337);(153.606079,0.022733);(153.69104,0.040494);(153.987457,0.09638);(154.019943,1.189007);(154.791534,0.04002);(154.852386,0.032679);(154.941895,0.029601);(155.000397,0.06228);(155.057755,0.520265);(155.285858,0.062991);(155.663696,0.0386);(155.819611,0.0386);(155.968704,0.055886);(157.062531,0.685082);(157.935379,0.033627);(158.063904,0.090697);(158.390503,0.014445);(159.040283,0.126218);(159.153244,0.032206);(159.283386,0.02889);(159.394699,0.065122);(160.001953,0.049019);(160.048111,0.076252);(160.985413,0.034337);(161.024231,2.919829);(162.024963,0.333187);(163.038696,0.095433);(164.863419,0.032679);(165.013428,0.088566);(165.032211,0.063464);(165.058273,0.027943);(165.121689,0.071989);(166.132034,0.032443);(166.604843,0.044993);(167.049728,0.488769);(168.050461,0.190156);(171.027267,0.852268);(171.108841,0.026286);(171.824814,0.066069);(172.046753,0.098512);(173.0224,0.080751);(173.047562,0.052098);(174.031952,0.035284);(175.021774,0.031022);(175.072678,0.060149);(176.077255,0.067253);(177.045044,0.037889);(177.451294,0.021313);(179.034912,0.442592);(180.040482,0.04523);(181.028198,0.029127);(183.038422,0.076252);(183.99379,0.035995);(184.053452,0.321584);(184.984161,0.030548);(185.022141,0.140426);(185.059265,0.645772);(185.095673,0.021313);(186.023148,0.060386);(186.061096,0.116746);(187.041794,0.088329);(188.046097,0.125034);(189.017639,0.017524);(189.056015,0.134743);(189.157791,0.016813);(190.061005,0.064175);(195.041458,0.340292);(196.052612,0.090934);(196.606308,0.039784);(197.054489,0.051387);(198.809586,0.041915);(199.031967,0.086198);(200.044968,0.053518);(201.053375,0.103485);(202.260513,0.049493);(202.653732,0.02226);(203.033752,0.358762);(203.134705,0.034337);(203.48912,0.032916);(204.035095,0.034574);(204.556396,0.072937);(209.152542,0.127876);(209.912018,0.059202);(210.014633,0.032679);(211.038345,0.032916);(212.049438,0.305955);(213.052811,1.134779);(214.059692,0.109642);(214.42485,0.016813);(215.498703,0.021786);(216.011642,0.057544);(216.042847,0.092355);(217.004059,0.036705);(217.039444,0.102301);(218.057266,0.063938);(219.06369,0.133559);(220.074066,0.048782);(221.043793,0.037652);(222.328949,0.049493);(223.034958,0.15795);(224.028778,0.040968);(225.285049,0.063938);(227.034622,0.032206);(227.519745,0.058254);(227.602066,0.049966);(228.03656,0.040731);(229.028717,0.041204);(229.049347,0.049493);(230.063354,0.035521);(231.065857,0.2091);(232.068985,0.045467);(235.336609,0.031732);(239.031342,0.026286);(240.044373,0.233728);(240.957748,0.024865);(241.048019,2.950614);(242.052582,0.206259);(242.166519,0.058728);(243.022385,0.035521);(243.058014,0.098275);(244.010681,0.043809);(245.046143,0.106326);(245.938248,0.051387);(250.515808,0.064885);(250.69252,0.022497);(251.03775,0.115325);(255.2668,0.058254);(258.049194,0.288668);(259.058594,0.228992);(260.060181,0.035047);(262.293365,0.02297);(262.874664,0.029364);(263.055878,0.050913);(265.99173,0.081935);(267.171265,0.025102);(269.001404,0.05115);(269.043182,1.180246);(270.050751,0.155345);(270.097168,0.041678);(279.688751,0.042862);(283.897858,0.024154);(284.753235,0.02297);(284.997559,0.053992);(285.501007,0.018945);(285.541992,0.04452);(285.914459,0.035521);(286.04837,0.108694);(286.152222,0.091171);(286.191437,0.035995);(286.240692,0.026049);(286.648376,0.033627);(286.74765,0.026522);(286.792267,0.130481);(286.832062,0.018945);(286.866058,0.121245);(286.896027,0.076962);(286.938904,0.169317);(287.054321,100.0);(287.167572,0.069148);(287.378571,0.039784);(287.495117,0.02889);(287.556458,0.090934);(287.674744,0.092118);(287.816772,0.043572);(287.968384,0.110352);(288.001434,0.037652);(288.057709,9.300591);(288.175049,0.02297);(288.696991,0.0341);(288.785461,0.02297);(288.909393,0.019892);(289.068115,0.052808);(289.42514,0.017287);(289.884552,0.0386);(289.928131,0.048309);(290.015686,0.032679);(290.053436,0.047835);(290.075592,0.074594);(290.146606,0.080278);(290.195526,0.057307);(290.296875,0.059912);(290.472748,0.017524);(291.042786,0.024628);(291.150879,0.02747);(297.7453,0.022497);(298.848602,0.018945);(299.24176,0.025575);(304.027954,0.025338);(308.626892,0.021313);(377.502655,0.019181);(399.39798,0.018945);(460.497498,0.032679);(480.279358,0.019418);(1372.359741,0.020602);(1602.55957,0.047361);(1669.33374,0.016103);(1760.354614,0.051861);(1888.918579,0.098038);(1962.591797,0.040731);(1975.523315,0.087855) | | LC-MS/MS | LC-ESI-QFT | positive | low | View Spectrum | (153.0182,65.44074341);(241.0497,17.69517702);(245.0497,16.86407958) | | LC-MS/MS | LC-ESI-IT | positive | low | View Spectrum | (135.2068,8.416053194);(153.1581,47.49465685);(161.1901,9.446687248);(219.1986,4.868202327);(231.2473,1.325100926);(241.0159,9.53217763);(245.2212,9.190216101);(269.2087,6.839230587);(287.3602,2.887675137) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (117.03595,1.2);(135.04485,3.1);(153.02142,5.5);(287.05505,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (117.03256,1.7);(135.04218,2.5);(153.01729,9.5);(161.02525,1.5);(287.05466,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (107.0173,4.3);(133.0331,8.01);(139.0556,1.0);(149.0287,2.0);(151.0077,4.0);(159.0464,1.0);(175.0438,2.4);(183.0467,2.8);(217.0573,2.4);(223.0472,1.0);(226.0361,1.0);(227.041,2.7);(229.0567,1.0);(241.0583,1.2);(243.0381,2.5);(255.0371,100.0);(256.0398,13.51);(257.0464,2.9);(283.0247,1.0);(285.0482,23.92);(286.0531,2.4) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (79.0534,1.6);(89.0382,3.9);(107.0489,1.2);(117.0337,1.2);(135.0431,2.7);(137.0222,1.0);(153.0172,33.43);(154.0208,2.3);(161.0224,4.2);(171.0276,2.7);(179.0331,1.7);(185.0589,1.4);(203.0328,1.5);(213.0536,2.4);(241.0488,7.71);(269.0436,3.6);(287.054,100.0);(289.0596,1.5) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (287.056,100.0);(288.062,4.5) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (117.0322,52.32);(135.04,44.37);(153.0183,100.0);(157.0619,14.57);(241.0438,18.54);(287.0508,30.46) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (133.0282,1.36);(256.0361,1.16);(284.0311,1.39);(285.04,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (55.019,1.5);(67.018,20.12);(68.997,29.83);(77.039,3.8);(79.055,4.1);(81.035,2.7);(83.014,1.4);(89.039,30.93);(97.03,3.6);(105.035,1.8);(107.049,3.4);(109.027,2.4);(111.008,3.4);(115.053,11.31);(117.033,24.32);(125.024,3.5);(127.049,4.5);(128.06,12.51);(129.066,5.01);(131.048,1.5);(133.027,1.8);(135.043,25.03);(137.025,17.72);(139.054,19.62);(143.045,2.5);(145.062,2.5);(147.042,2.4);(153.018,100.0);(154.023,2.7);(155.056,3.5);(157.065,5.81);(161.026,26.33);(167.053,2.7);(168.06,1.0);(171.047,6.61);(179.04,1.2);(184.058,2.0);(185.064,4.6);(187.044,1.0);(195.048,2.4);(212.05,3.3);(213.059,4.7);(229.052,1.4);(240.044,1.5);(241.054,7.31);(287.055,4.5) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (105.0346,3.91);(107.0136,13.92);(117.0331,1.08);(121.029,4.67);(132.021,8.46);(133.0291,100.0);(133.0632,1.64);(133.0804,1.44);(133.1366,1.5);(145.0314,1.78);(149.0251,4.27);(151.0026,6.86);(173.0258,1.24);(174.0296,1.04);(175.0402,7.59);(182.036,1.06);(197.0227,1.01);(198.0341,2.34);(199.038,3.5);(201.0197,2.97);(211.0378,1.02);(215.0341,1.01);(285.04,1.61) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (107.0138,1.35);(133.0288,7.03);(149.0248,2.02);(151.0028,5.42);(175.0397,3.65);(199.0414,2.91);(213.0586,1.08);(217.0495,2.46);(241.0509,1.93);(243.0288,1.34);(256.0324,2.44);(257.0378,1.61);(285.0398,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (67.018,2.4);(68.996,1.8);(89.038,1.5);(107.048,1.1);(111.007,2.2);(117.032,5.51);(135.043,23.92);(137.023,7.21);(139.054,1.1);(153.018,77.28);(154.022,1.6);(157.065,1.3);(161.026,8.91);(171.042,2.1);(179.039,3.4);(185.065,2.0);(203.04,1.4);(213.059,3.1);(231.067,1.0);(241.054,11.21);(245.049,1.5);(269.048,4.7);(287.055,100.0);(288.06,5.01) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (41.0036,2.08);(63.0244,5.85);(65.0039,15.14);(77.0397,2.47);(79.0189,1.12);(83.014,5.51);(104.0268,1.47);(105.0343,3.52);(107.0135,9.11);(115.0186,1.75);(121.0289,4.13);(132.0212,13.79);(133.0293,100.0);(134.0328,1.17);(143.0492,1.39);(145.0288,1.56);(149.0244,2.8);(151.0034,4.74);(174.0328,1.08);(175.0395,4.36);(198.0315,1.2);(199.0397,2.03);(201.0187,1.44) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (43.0193,13.6);(55.019,1.1);(67.019,24.03);(68.9984,25.72);(77.0395,4.38);(79.0551,4.74);(81.0343,2.43);(83.0129,1.01);(89.0394,22.53);(97.0288,2.5);(107.0493,3.93);(109.0292,3.93);(111.0082,4.02);(115.054,3.89);(117.0341,16.62);(125.0239,2.36);(127.054,2.08);(128.0621,2.87);(129.0695,2.54);(133.0285,1.67);(135.0442,35.96);(137.0235,11.83);(139.0543,5.84);(143.0476,1.13);(147.0441,1.47);(153.0185,100.0);(157.0637,3.64);(161.0237,14.58);(167.0494,2.0);(171.0438,3.27);(179.0341,2.9);(185.0595,4.51);(195.0444,1.86);(199.0391,1.09);(203.0368,1.77);(212.0462,2.03);(213.055,6.5);(241.0499,12.42);(258.0519,1.27);(269.044,4.17);(287.0555,41.69) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (153.0186,2.54);(287.0559,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (132.02319,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (170.48761,9.5);(187.76443,8.2);(285.04269,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (133.01991,97.9);(133.02621,100.0);(155.04402,37.5);(175.04498,54.2) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (287.0559,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (63.0249,15.1);(67.01936,29.4);(68.99687,35.0);(75.02226,3.0);(75.90524,3.2);(77.04027,29.9);(81.03233,24.2);(83.00492,6.7);(84.0127,6.5);(87.02254,8.2);(88.01857,6.5);(89.03936,100.0);(90.03629,10.3);(91.05192,3.5);(92.05616,5.3);(97.03118,3.2);(99.02529,3.5);(101.02837,5.4);(108.01685,4.2);(109.02698,18.4);(111.02964,4.6);(114.04432,10.0);(115.05529,25.0);(117.03162,12.3);(118.02979,10.2);(119.85185,5.6);(125.02636,3.9);(126.04059,5.6);(127.04561,12.6);(128.06033,36.6);(129.06787,9.5);(129.68948,3.5);(132.06195,3.2);(133.02718,18.6);(135.04343,26.8);(136.04883,5.8);(137.02222,8.9);(139.05457,38.9);(140.05775,13.3);(143.01007,11.4);(144.05353,4.0);(147.04089,7.9);(148.05247,7.4);(153.01608,64.6);(157.0719,12.3);(158.0657,3.0);(159.05016,4.7);(161.01886,18.2);(165.03442,7.9);(166.04405,6.1);(167.04926,16.6);(168.05907,3.3);(171.04836,18.7);(172.04529,3.5);(181.01935,4.7);(184.05469,8.6);(185.05447,5.8);(186.05791,5.8);(195.0463,8.4);(212.05322,6.3);(213.05443,5.8);(230.06964,4.4);(258.0589,5.6);(260.05032,4.2) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (204.91451,2.6);(222.78365,2.5);(255.02654,2.1);(284.02872,3.6);(285.03925,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (133.02606,100.0);(152.00432,24.5);(169.0636,20.4);(175.04039,21.4) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (119.33452,5.4);(213.05898,6.4);(257.05276,5.1);(281.15201,4.9);(285.03802,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (63.0246,2.02);(65.0044,6.35);(83.0138,5.52);(105.0345,2.93);(107.0139,14.51);(121.0287,4.63);(132.0204,6.1);(133.0282,100.0);(143.0498,1.56);(145.0287,1.5);(147.0435,1.3);(149.0236,5.22);(151.0021,9.34);(171.0441,1.84);(174.03,1.1);(175.0391,7.23);(198.0315,1.77);(199.0384,3.9);(201.0176,2.77);(215.0341,1.35);(217.0483,1.28);(285.0399,2.18) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (67.02007,2.5);(68.99553,2.5);(89.0393,2.5);(107.04883,1.4);(109.02779,2.1);(111.01074,1.9);(117.03096,3.4);(125.02931,1.2);(135.04399,22.7);(136.04457,1.2);(137.02196,7.0);(153.0179,70.9);(154.02292,3.5);(161.02316,5.9);(179.03368,2.0);(185.05969,2.4);(195.04683,1.3);(212.0574,1.3);(213.05276,2.9);(241.05031,6.4);(242.05536,1.5);(245.04424,1.3);(269.04037,5.5);(270.05334,1.4);(287.05466,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (103.05648,61.5);(117.0378,42.3);(130.03873,100.0);(141.03107,69.2);(161.02632,44.2) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (133.02512,6.6);(186.05424,7.5);(215.03751,9.1);(242.80959,5.6);(255.02425,5.6);(257.05185,10.0);(258.03647,6.2);(285.04083,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (133.02483,100.0);(136.01709,24.7);(159.04558,40.3);(183.04088,23.4);(187.03789,27.3);(196.06554,44.2) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (119.04778,19.5);(144.04836,20.3);(159.03679,16.9);(285.03909,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (135.04442,2.9);(153.01859,9.2);(287.05502,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (287.00897,1.4);(287.05411,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (55.0172,1.8);(63.02765,4.3);(67.01804,25.0);(68.99429,18.0);(76.02751,1.6);(77.03752,4.8);(78.04134,7.8);(79.05349,10.6);(81.03571,3.1);(83.01504,2.9);(85.74739,2.3);(87.02402,17.7);(88.02489,3.2);(89.04064,29.9);(90.04373,4.1);(91.01425,3.6);(92.19519,1.6);(93.0336,2.1);(93.99358,3.0);(95.05257,3.7);(97.03214,2.5);(99.0219,5.0);(101.0205,2.4);(103.03292,4.7);(107.0536,1.7);(109.03545,6.3);(111.01944,3.9);(113.03757,2.3);(115.05279,13.0);(117.0361,7.1);(118.03017,2.0);(119.01224,2.5);(121.02292,4.2);(123.04592,2.2);(125.03826,6.0);(126.0259,1.9);(127.05528,8.7);(128.06129,32.9);(129.07137,5.5);(131.04774,3.3);(133.02811,5.1);(134.0376,1.9);(135.04489,6.7);(137.02705,8.1);(139.05516,48.9);(140.06367,4.7);(141.06136,2.4);(142.03258,1.8);(143.05238,4.6);(145.05957,4.3);(146.04507,1.8);(147.04567,4.5);(148.04622,4.3);(149.03709,1.6);(150.02357,3.2);(153.01833,100.0);(154.02135,12.8);(155.05502,8.8);(157.01767,4.5);(159.04762,1.9);(160.0582,2.5);(161.026,20.3);(162.02756,3.5);(163.03108,1.8);(165.02119,1.8);(167.0479,7.8);(171.03818,10.1);(174.03519,2.7);(183.04782,1.6);(184.05183,4.1);(185.06104,4.3);(186.02798,1.8);(187.04019,1.8);(195.03799,4.0);(203.03952,1.5);(203.74004,1.8);(212.01932,4.0);(213.03998,3.1);(229.05286,2.2);(241.04469,1.8);(242.04976,1.9);(244.24734,2.5);(245.04979,3.2);(258.05466,2.4);(268.02649,1.7);(287.04385,6.2) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (109.02547,15.6);(151.00125,20.7);(154.04274,27.4);(156.05476,17.8);(199.03625,14.1);(256.02423,20.7);(284.02197,17.8);(285.04178,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (117.03832,64.5);(157.02054,80.6);(161.02173,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (67.0166,2.1);(68.99811,1.4);(111.00835,2.3);(117.034,6.2);(135.0434,20.4);(136.0451,1.4);(137.0242,6.4);(147.04285,1.3);(153.01823,63.9);(154.02351,3.4);(157.06598,1.2);(161.02333,6.2);(162.02641,1.6);(171.04347,1.5);(179.03436,2.2);(213.04984,2.5);(219.06244,1.3);(241.04715,6.5);(269.04471,4.8);(287.05569,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (65.0037,1.37);(107.0136,2.66);(133.0291,15.67);(149.0241,2.9);(151.0035,9.18);(175.04,4.99);(199.0397,4.31);(201.0197,1.68);(217.05,3.22);(241.0494,2.19);(243.029,1.59);(257.0442,1.03);(285.0402,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (287.05463,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (67.01895,1.9);(68.99664,1.8);(89.04025,2.0);(107.05076,1.1);(111.00669,2.2);(117.03362,4.8);(135.04456,18.2);(136.0361,1.5);(137.02455,4.9);(147.04346,1.1);(153.01814,58.1);(154.0209,4.0);(157.06477,1.6);(161.02319,8.4);(162.02957,1.1);(171.04686,1.3);(179.03189,4.3);(185.06108,1.7);(213.0497,1.8);(241.04688,7.6);(242.06659,1.1);(269.03867,4.3);(287.05469,100.0) | | LC-MS/MS | Not Available | Negative | Not Available | View Spectrum | (133.0293,1.93);(151.0039,1.09);(285.0403,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (287.05414,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (63.02432,4.2);(67.01955,24.1);(68.99669,37.9);(69.62658,3.1);(71.24132,3.0);(77.03741,8.2);(79.05196,15.4);(81.03401,10.1);(82.03726,5.8);(87.02093,17.5);(89.04148,53.0);(90.04122,4.4);(91.05852,6.1);(97.02938,8.6);(98.03192,4.5);(107.04816,6.3);(109.02826,4.5);(111.03848,6.5);(115.05882,7.3);(117.02864,16.6);(118.02705,4.0);(121.02354,4.2);(123.01914,3.8);(125.03879,4.9);(127.05951,7.5);(128.06117,17.8);(129.07288,3.5);(130.48288,4.4);(131.0504,3.8);(131.55528,4.7);(133.02119,4.5);(135.04614,16.3);(136.02045,3.5);(137.02036,19.8);(139.05769,23.4);(140.05966,10.7);(143.00961,3.7);(145.06888,9.8);(147.9057,6.1);(152.05783,4.9);(153.0188,100.0);(155.02208,9.1);(157.0192,5.6);(161.02571,28.8);(171.04982,15.0);(174.03072,3.5);(179.03452,7.7);(184.03801,4.2);(187.03664,10.5);(204.03815,3.5);(205.3721,4.2);(211.04391,4.9);(212.04755,3.7);(218.0565,4.2);(244.58731,3.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (153.02,1.08);(287.056,100.0);(288.062,4.66) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (287.056,100.0);(288.062,3.36) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (67.0166,2.1);(68.99811,1.4);(111.00835,2.3);(117.034,6.21);(135.0434,20.42);(136.0451,1.4);(137.0242,6.41);(147.04285,1.3);(153.01823,63.86);(154.02351,3.4);(157.06598,1.2);(161.02333,6.21);(162.02641,1.6);(171.04347,1.5);(179.03436,2.2);(212.04941,1.0);(213.04984,2.5);(219.06244,1.3);(241.04715,6.51);(269.04471,4.8);(287.05569,100.0) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (55.019,1.68);(67.018,20.26);(68.997,29.99);(77.039,3.91);(79.055,4.27);(81.035,2.81);(83.014,1.52);(89.039,31.01);(97.03,3.73);(105.035,2.0);(107.049,3.53);(109.027,2.59);(111.008,3.57);(115.053,11.44);(117.033,24.5);(121.029,1.06);(125.024,3.62);(127.049,4.67);(128.06,12.61);(129.066,5.1);(131.048,1.62);(133.027,1.96);(135.043,25.16);(137.025,17.81);(139.054,19.73);(143.045,2.66);(145.062,2.62);(147.042,2.58);(153.018,100.0);(154.023,2.85);(155.056,3.65);(157.065,5.96);(161.026,26.45);(167.053,2.85);(168.06,1.18);(171.047,6.73);(179.04,1.36);(184.058,2.1);(185.064,4.79);(187.044,1.15);(195.048,2.54);(203.038,1.04);(212.05,3.43);(213.059,4.83);(229.052,1.57);(240.044,1.64);(241.054,7.44);(287.055,4.65) | | LC-MS/MS | Not Available | Positive | Not Available | View Spectrum | (67.018,2.57);(68.996,1.98);(89.038,1.62);(107.048,1.24);(111.007,2.34);(117.032,5.65);(125.02,1.04);(135.043,24.03);(137.023,7.37);(139.054,1.29);(153.018,77.36);(154.022,1.78);(157.065,1.48);(161.026,9.05);(171.042,2.26);(179.039,3.59);(185.065,2.16);(203.04,1.57);(213.059,3.24);(231.067,1.18);(241.054,11.39);(245.049,1.62);(269.048,4.86);(287.055,100.0);(288.06,5.19) | | Predicted LC-MS/MS | Not Available | Positive | low | View Spectrum | (55.01838972,0.122014622);(57.03403978,0.0592341681);(83.01330434,0.1168207489);(85.0289544,0.0470372037);(109.0289544,2.117345079);(111.0446045,0.0410258134);(133.0289544,0.2382775776);(135.0446045,0.1704235262);(151.0395191,0.1358618279);(153.0187836,0.5939685186);(155.0344337,0.0337771044);(161.023869,0.0284805442);(179.0344337,0.2401434292);(203.0344337,0.2502743046);(205.0500838,0.0492316315);(229.0500838,0.0505207673);(231.0293483,0.0880141423);(233.0449984,0.136604321);(239.0344337,0.0382701973);(243.0293483,0.2361211072);(245.0449984,0.2947689572);(251.0344337,0.2047175222);(255.0293483,0.2212996842);(257.0449984,0.345777404);(257.0449984,0.3273560384);(259.0242629,0.2702646009);(261.039913,0.0892750336);(269.0449984,16.37510727);(271.0242629,0.2270250378);(271.0242629,0.2274143955);(287.0555631,76.62354742) | | Predicted LC-MS/MS | Not Available | Positive | med | View Spectrum | (55.01838972,0.6948680573);(57.03403978,0.3057077327);(79.01838972,0.5756729134);(83.01330434,0.2363656484);(85.0289544,0.4723127506);(109.0289544,4.647579143);(133.0289544,0.2753864798);(135.0446045,0.2767430328);(137.023869,0.9109861238);(153.0187836,0.852124065);(161.023869,0.2664086831);(179.0344337,0.2420629408);(203.0344337,1.486434953);(205.0500838,0.5392055912);(213.0551691,0.3460335815);(229.0500838,0.9474609745);(231.0293483,0.3871344403);(231.0657338,0.9121862636);(233.0449984,0.5599020945);(239.0344337,0.8985671427);(243.0293483,1.305384475);(245.0449984,1.866518986);(251.0344337,1.158384971);(255.0293483,0.9016712649);(257.0449984,3.363215962);(257.0449984,3.379131295);(259.0242629,0.2979633703);(269.0449984,21.07291119);(271.0242629,0.4441767402);(271.0242629,0.3097886034);(287.0555631,50.06771053) | | Predicted LC-MS/MS | Not Available | Positive | high | View Spectrum | (51.0234751,4.757694236);(53.03912516,2.365656844);(55.01838972,2.450225853);(67.01838972,1.694879462);(68.99765427,2.399670952);(69.03403978,2.595525033);(77.03912516,1.615135119);(79.01838972,2.776730186);(83.01330434,1.364033573);(85.0289544,1.424281543);(93.03403978,1.459323621);(109.0289544,9.56347754);(133.0289544,3.414769755);(135.008219,2.12415032);(135.0446045,1.653395195);(137.023869,4.276413691);(153.0187836,6.12452211);(161.023869,2.407794697);(179.0344337,1.540253032);(187.0395191,1.263173189);(201.0551691,1.20966021);(203.0344337,2.982636247);(211.0395191,1.328220178);(213.0551691,7.25000721);(227.0344337,3.653692786);(229.0500838,1.468065668);(239.0344337,1.976354203);(243.0293483,2.690611468);(245.0449984,3.175720369);(251.0344337,3.871646314);(269.0449984,13.1222794) | | Predicted LC-MS/MS | Not Available | Negative | low | View Spectrum | (41.00273965,0.1148766296);(43.01838972,0.0265249947);(53.00273965,0.0852835412);(55.01838972,0.0875443642);(83.01330434,0.0407579195);(107.0133043,0.0684964215);(109.0289544,0.0618681596);(125.023869,0.1900032651);(131.0133043,0.029154512);(133.0289544,0.2552899834);(149.023869,0.3586267044);(151.0031336,0.6142299424);(153.0187836,0.0526723687);(159.008219,0.0293309929);(175.0031336,0.0309014669);(177.0187836,0.2808888719);(201.0187836,0.0594389292);(203.0344337,0.0279759982);(215.0344337,0.2483760756);(227.0344337,0.2183548185);(229.0136983,0.1224243532);(229.0500838,0.0680522324);(231.0293483,0.073217502);(241.0136983,0.1361556454);(243.0293483,0.6774315525);(255.0293483,0.3329602553);(257.0086129,0.0623560147);(259.0242629,0.2297062765);(267.0293483,5.021693676);(269.0086129,0.0501450298);(285.039913,90.3452615) | | Predicted LC-MS/MS | Not Available | Negative | med | View Spectrum | (17.00273965,0.32007142);(41.00273965,0.6450922977);(53.00273965,0.2153999642);(55.01838972,0.3862630749);(68.99765427,0.1261383308);(83.01330434,0.4561952732);(107.0133043,0.2426014288);(109.0289544,0.2332418108);(125.023869,1.428468965);(133.0289544,0.5834202581);(135.008219,0.8546714627);(149.023869,0.2052453906);(151.0031336,1.478862522);(153.0187836,0.1384480149);(159.008219,0.6367305529);(177.0187836,1.343817252);(201.0187836,0.8993192612);(215.0344337,1.149662578);(227.0344337,1.835633184);(229.0136983,0.1614979538);(229.0500838,0.6449365684);(231.0293483,0.344001571);(241.0136983,2.009797738);(243.0293483,5.563439928);(253.0136983,0.5352961174);(255.0293483,0.8214362882);(257.0086129,0.4403730297);(259.0242629,0.5272350664);(267.0293483,7.008355857);(269.0086129,0.163807425);(285.039913,68.60053941) | | Predicted LC-MS/MS | Not Available | Negative | high | View Spectrum | (41.00273965,4.30905836);(65.00273965,5.025760989);(67.01838972,3.517529999);(83.01330434,3.458586098);(91.01838972,3.524845983);(92.99765427,1.819560679);(107.0133043,3.191190963);(108.9925689,0.9377828044);(109.0289544,6.317669653);(125.023869,2.189325529);(131.0133043,2.96680679);(133.0289544,4.260578785);(135.008219,5.138172856);(149.023869,2.265677902);(151.0031336,6.913597939);(159.008219,2.37439936);(173.023869,5.117027934);(177.0187836,1.002890182);(197.023869,0.9409387385);(199.0395191,1.231412541);(201.0187836,7.175247838);(215.0344337,3.534595733);(225.0187836,1.21237662);(227.0344337,1.091579818);(231.0293483,1.031413476);(241.0136983,2.893193414);(243.0293483,5.724745942);(255.0293483,1.943589933);(267.0293483,5.8076366);(269.0086129,1.102341142);(285.039913,1.980465402) |
| 
