| Spectrum Type | Instrument Type | Ion Mode | Collision Energy Level | View | Peaks |
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| Predicted GC-MS | GC-MS | Positive | Not Available | View Spectrum | (80.96408832,4.112446655);(94.04131312,1.620950594);(105.0334885,1.938425407);(106.0413131,1.770333118);(107.0491377,2.845238199);(123.0440518,1.89257508);(157.0647869,2.024022101);(188.9852149,1.512202713);(197.059701,1.878647373);(199.0753502,4.408272763);(203.0008641,1.693957775);(209.059701,1.785212413);(210.0675256,1.62346042);(211.0753502,2.163879358);(212.0831748,2.570808413);(224.0467905,2.485323467);(225.0546151,3.594757498);(226.0624397,4.091248769);(227.0702643,7.514146339);(228.0780889,14.21462059);(229.0814834,2.269219384);(264.0086887,1.696391406);(266.0243379,1.484837048);(278.0243379,1.6667091);(279.0321625,3.816449247);(280.0399871,1.920115804);(290.0243379,2.198663899);(291.0321625,3.276588838);(293.0114274,1.62677714);(307.0270766,7.873929302);(308.0349012,6.429789789) | | Predicted GC-MS | GC-MS | Positive | Not Available | View Spectrum | (71.03115062,0.6635666808);(73.04679982,11.51449535);(74.04796012,0.9852520304);(75.02606472,2.863498931);(80.96408832,0.6836039293);(178.0808369,0.6259031382);(336.0482125,0.6193864861);(350.0638617,0.801842347);(351.0716863,2.714170028);(352.0741622,0.6577925976);(357.1336627,5.596694781);(358.1358526,1.784384444);(359.1339169,0.6739373199);(363.0716863,0.618494773);(365.0509512,2.447762723);(369.1336627,0.942522562);(370.1414873,0.6401222191);(371.1493119,2.618837067);(372.151545,0.8650600711);(372.1571365,0.9048600424);(378.0587758,0.7694204101);(379.0666004,2.981343603);(380.0691176,0.7570340695);(380.074425,2.557709408);(381.0769445,0.6498469826);(381.0822496,1.480375158);(436.0826504,0.767776615);(437.090475,8.616762445);(438.0926043,2.824971471);(439.089765,1.49699586);(452.1139488,0.7775039154) | | Predicted GC-MS | GC-MS | Ei | Not Available | View Spectrum | (80.96408832,1.473312122);(94.04131312,1.085664388);(105.0334885,1.165829079);(106.0413131,1.052268712);(107.0491377,1.451384383);(157.0647869,0.9436419881);(188.9852149,0.8513174591);(189.9930395,0.9221901271);(199.0753502,1.682888205);(203.0008641,0.8133728294);(209.059701,1.195682058);(210.0675256,1.087345395);(211.0753502,1.44930189);(212.0831748,1.721850841);(224.0467905,1.661416005);(225.0546151,2.471287564);(226.0624397,2.067431261);(227.0702643,4.531316092);(228.0780889,7.232352808);(229.0814834,1.154571456);(251.0008641,0.9523099914);(264.0086887,1.017033532);(266.0243379,0.8322858651);(278.0243379,1.152477955);(279.0321625,2.778809936);(280.0399871,1.319263134);(290.0243379,1.472599538);(291.0321625,2.194561531);(293.0114274,1.218091482);(308.0349012,4.795730069);(309.0381136,0.8088363213) | | Predicted LC-MS/MS | Not Available | Positive | low | View Spectrum | (43.01838972,0.1879524993);(80.96463989,1.273407551);(82.98028996,0.1177491165);(95.04968984,0.765412693);(98.97520458,0.7680240526);(119.0496898,1.914026136);(122.9752046,0.189863207);(143.0496898,0.1689834973);(145.0653399,0.130574503);(159.08099,0.2030344591);(185.0602545,0.1591289663);(187.0759046,0.1689545172);(191.0014193,0.7589425188);(211.0759046,6.898451876);(215.0014193,1.895115644);(227.0708192,0.1009278887);(229.0170694,0.1104711598);(229.0864693,1.059027034);(239.0014193,0.1201640338);(265.0170694,0.3041866589);(267.0327195,0.2447322646);(273.0221548,0.095918033);(277.0170694,0.222768881);(279.0327195,0.4235880914);(281.011984,0.1216226514);(283.0276341,0.092769241);(291.0327195,13.53413363);(291.0327195,1.62399278);(293.011984,1.107750448);(293.011984,0.220257669);(309.0432841,65.0180683) | | Predicted LC-MS/MS | Not Available | Positive | med | View Spectrum | (80.96463989,4.877581784);(95.04968984,0.9335719848);(98.97520458,0.576202675);(111.0446045,0.3833153115);(119.0496898,4.312432164);(135.0446045,1.726764135);(143.0496898,1.398689248);(145.0653399,1.172860603);(169.0653399,0.8116361738);(185.0602545,0.9176363194);(187.0759046,0.6238877386);(191.0014193,0.5229200167);(193.0653399,0.4651386468);(197.0602545,0.2681779279);(199.0759046,1.099658845);(211.0759046,19.80411897);(215.0014193,2.042348942);(227.0708192,2.282317177);(229.0864693,19.22129423);(249.0221548,0.6959713228);(251.0014193,0.3467910598);(261.0221548,0.2940234583);(265.0170694,1.439021771);(267.0327195,0.7383209452);(273.0221548,0.6702754523);(277.0170694,0.2746602618);(279.0327195,0.4915927308);(291.0327195,18.4375225);(291.0327195,0.6336757247);(293.011984,1.239769897);(309.0432841,11.29782199) | | Predicted LC-MS/MS | Not Available | Positive | high | View Spectrum | (51.0234751,3.44034924);(65.03912516,2.396429241);(77.03912516,1.221122425);(79.01838972,1.930924137);(80.96463989,3.627328505);(89.03912516,2.906345879);(93.03403978,1.96443854);(95.04968984,1.411517973);(119.0496898,5.25055082);(129.0704253,1.64215146);(135.0446045,2.060744616);(143.0496898,8.737903477);(159.08099,1.303891076);(167.0496898,3.047632888);(169.0289544,1.179792849);(169.0653399,10.45978765);(181.0653399,4.915057778);(185.0602545,1.883502556);(191.0014193,1.671192168);(193.0653399,4.711323366);(211.0759046,13.07679282);(215.0014193,4.67201701);(239.0014193,1.776925735);(249.0221548,1.783957262);(259.0065047,1.32699809);(261.0221548,1.573798172);(265.0170694,1.395236886);(277.0170694,1.178046193);(291.0327195,2.67379773);(291.0327195,2.739698273);(293.011984,2.040745181) | | Predicted LC-MS/MS | Not Available | Negative | low | View Spectrum | (17.00273965,0.0715995918);(41.00273965,0.0669107761);(43.01838972,0.0113214828);(80.96463989,1.105963109);(93.03403978,0.1555774705);(96.95955451,1.457634477);(109.0289544,0.0068350703);(117.0340398,0.0234919829);(120.9595545,0.0042534509);(143.0496898,0.0308508391);(157.0653399,0.2337761975);(169.0289544,0.0042061737);(183.0446045,0.0764078506);(185.0602545,0.1620289841);(188.9857693,0.1507337026);(191.0496898,0.0049899508);(197.0602545,0.0054885697);(209.0602545,1.75056294);(212.9857693,0.0226399515);(225.0551691,0.3722645845);(227.0708192,5.855425362);(239.0014193,0.0251741988);(263.0014193,0.0850846796);(265.0170694,0.2384782816);(271.0065047,0.009896056);(275.0014193,0.0772006389);(277.0170694,0.1563616045);(281.011984,0.0756028486);(289.0170694,4.287961021);(290.9963339,0.014415271);(307.0276341,83.45686288) | | Predicted LC-MS/MS | Not Available | Negative | med | View Spectrum | (17.00273965,0.518865011);(41.00273965,0.0530732224);(80.96463989,1.717378983);(93.03403978,0.2884404848);(96.95955451,2.066201509);(109.0289544,0.1862465275);(117.0340398,0.07481453);(133.0289544,0.1208099992);(143.0496898,0.1563548624);(157.0653399,0.911834373);(159.08099,0.0519167902);(183.0446045,2.12735695);(185.0602545,4.740063864);(188.9857693,0.1724384646);(195.0446045,0.1016297099);(197.0602545,0.3740335085);(199.0395191,0.0505895225);(201.0551691,0.073970848);(209.0602545,7.671646084);(211.0395191,0.0636705059);(225.0551691,5.700820439);(227.0708192,46.58754627);(239.0014193,0.0592925298);(263.0014193,0.5608469085);(265.0170694,0.7526214422);(275.0014193,0.3683768921);(277.0170694,0.2036629072);(281.011984,0.1354182501);(289.0170694,2.564094572);(290.9963339,0.0431824318);(307.0276341,21.50280161) | | Predicted LC-MS/MS | Not Available | Negative | high | View Spectrum | (41.00273965,1.974394249);(43.01838972,0.3272153058);(67.01838972,0.3923811444);(80.96463989,13.49039808);(93.03403978,4.13149455);(96.95955451,1.394861921);(109.0289544,2.933064812);(117.0340398,1.176238099);(133.0289544,2.013674057);(143.0496898,0.8726037752);(157.0653399,3.398862471);(159.08099,1.146238126);(167.0133043,0.401250951);(169.0289544,1.492137757);(171.0446045,0.4688735915);(183.0446045,2.891177331);(185.0602545,5.599156251);(188.9857693,0.3336703756);(195.0446045,1.285256408);(197.023869,0.5368714092);(197.0602545,3.094633618);(207.0446045,0.673041178);(209.0602545,16.68240355);(211.0395191,0.9450347454);(225.0551691,3.044894363);(227.0708192,23.7859272);(263.0014193,0.8177743935);(265.0170694,0.3952536057);(271.0065047,0.6562258812);(289.0170694,3.240255951);(290.9963339,0.4047348525) | | Predicted LC-MS/MS | Not Available | Positive | low | View Spectrum | (229.08592,12.51);(229.08592,12.51);(229.08592,12.51);(229.08592,12.51);(229.08592,12.51);(229.08592,12.51);(229.08592,12.51);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0);(309.04274,100.0) | | Predicted LC-MS/MS | Not Available | Positive | medium | View Spectrum | (80.96409,17.63);(98.97466,13.21);(119.04914,19.36);(119.04914,19.36);(119.04914,19.36);(119.04914,19.36);(119.04914,19.36);(133.02841,17.02);(135.04406,21.05);(157.06479,17.09);(157.06479,17.09);(157.06479,17.09);(159.08044,14.76);(159.08044,14.76);(183.04406,10.5);(183.04406,10.5);(183.04406,10.5);(183.04406,10.5);(195.08044,13.55);(195.08044,13.55);(199.07536,28.06);(199.07536,28.06);(199.07536,28.06);(211.07536,64.58);(211.07536,64.58);(211.07536,64.58);(211.07536,64.58);(211.07536,64.58);(211.07536,64.58);(211.07536,64.58);(213.09101,13.96);(213.09101,13.96);(213.09101,13.96);(213.09101,13.96);(213.09101,13.96);(213.09101,13.96);(213.09101,13.96);(225.05462,16.08);(225.05462,16.08);(225.05462,16.08);(225.05462,16.08);(227.07027,100.0);(227.07027,100.0);(227.07027,100.0);(227.07027,100.0);(227.07027,100.0);(227.07027,100.0);(229.08592,81.69);(229.08592,81.69);(229.08592,81.69);(229.08592,81.69);(229.08592,81.69);(229.08592,81.69);(229.08592,81.69);(281.04782,11.38);(281.04782,11.38);(281.04782,11.38);(281.04782,11.38);(291.03217,28.3);(291.03217,28.3);(291.03217,28.3);(291.03217,28.3);(291.03217,28.3);(291.03217,28.3);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79);(309.04274,64.79) | | Predicted LC-MS/MS | Not Available | Positive | high | View Spectrum | (65.03858,17.88);(75.02293,30.31);(79.05423,21.0);(79.05423,21.0);(80.96409,30.72);(91.05423,50.16);(103.05423,53.06);(117.03349,26.62);(117.03349,26.62);(117.03349,26.62);(119.04914,35.67);(119.04914,35.67);(119.04914,35.67);(119.04914,35.67);(119.04914,35.67);(125.03858,28.29);(141.03349,54.11);(141.03349,54.11);(141.03349,54.11);(145.06479,55.62);(157.06479,32.95);(157.06479,32.95);(157.06479,32.95);(165.03349,20.26);(167.04914,31.99);(167.04914,31.99);(167.04914,31.99);(167.04914,31.99);(169.06479,24.56);(169.06479,24.56);(169.06479,24.56);(171.08044,26.08);(171.08044,26.08);(171.08044,26.08);(171.08044,26.08);(181.06479,64.28);(181.06479,64.28);(183.04406,37.85);(183.04406,37.85);(183.04406,37.85);(183.04406,37.85);(183.08044,51.37);(183.08044,51.37);(187.07536,18.46);(187.07536,18.46);(187.07536,18.46);(193.06479,43.97);(195.08044,43.97);(195.08044,43.97);(199.07536,100.0);(199.07536,100.0);(199.07536,100.0);(211.07536,76.56);(211.07536,76.56);(211.07536,76.56);(211.07536,76.56);(211.07536,76.56);(211.07536,76.56);(211.07536,76.56);(213.09101,18.39);(213.09101,18.39);(213.09101,18.39);(213.09101,18.39);(213.09101,18.39);(213.09101,18.39);(213.09101,18.39);(239.00087,43.16);(263.00087,25.1);(263.00087,25.1);(263.00087,25.1);(263.03726,19.83);(267.03217,43.3);(267.03217,43.3);(267.03217,43.3);(267.03217,43.3);(267.03217,43.3);(279.03217,25.12);(279.03217,25.12) | | Predicted LC-MS/MS | Not Available | Negative | low | View Spectrum | (307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0) | | Predicted LC-MS/MS | Not Available | Negative | medium | View Spectrum | (80.96519,7.09);(96.9601,17.36);(157.06589,3.89);(225.05572,2.5);(225.05572,2.5);(225.05572,2.5);(227.00197,3.59);(227.07137,7.43);(227.07137,7.43);(227.07137,7.43);(227.07137,7.43);(227.07137,7.43);(227.07137,7.43);(227.07137,7.43);(239.00197,2.97);(251.00197,3.39);(253.01762,4.66);(276.98123,4.45);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0);(307.02818,100.0) | | Predicted LC-MS/MS | Not Available | Negative | high | View Spectrum | (68.9982,17.03);(80.96519,100.0);(93.03459,6.95);(96.9601,75.04);(117.03459,6.37);(119.05024,26.61);(119.05024,26.61);(119.05024,26.61);(119.05024,26.61);(120.9601,22.87);(133.0295,8.15);(143.05024,23.07);(144.9601,7.54);(157.06589,12.98);(171.04515,7.99);(171.04515,7.99);(199.07645,9.83);(199.07645,9.83);(209.0608,6.39);(209.0608,6.39);(227.00197,32.36);(227.07137,5.98);(227.07137,5.98);(227.07137,5.98);(227.07137,5.98);(227.07137,5.98);(227.07137,5.98);(227.07137,5.98);(251.00197,7.41);(275.00197,8.62);(275.00197,8.62);(305.01253,7.93) |
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