| Spectrum Type | Instrument Type | Ion Mode | Collision Energy Level | View | Peaks |
|---|
| | | | | | |
|---|
| LC-MS/MS | LC-ESI-QFT | Negative | medium | View Spectrum | (50.094731,0.00004034);(50.22142,0.00006903);(50.378933,0.00005037);(50.56859,0.00009197);(50.944941,0.00005583);(51.300721,0.00006038);(51.583345,0.00003677);(51.97598,0.00003461);(52.673644,0.00004047);(52.724351,0.00006329);(53.311706,0.00005846);(53.412444,0.00005054);(53.439379,0.00007113);(53.520334,0.00005545);(53.643406,0.00004584);(53.672672,0.00005395);(53.805618,0.00006986);(53.850155,0.00003514);(54.935932,0.00005138);(55.017525,0.00004594);(55.052373,0.00004545);(55.307591,0.00005969);(55.354299,0.00003448);(55.796452,0.00004642);(55.82069,0.00004211);(55.953134,0.00003995);(56.009905,0.00005093);(56.170672,0.00006342);(56.948801,0.00006181);(57.033322,0.00004473);(57.888959,0.00004748);(58.048132,0.0000337);(58.449339,0.00007673);(58.771261,0.00003425);(58.778356,0.00006799);(58.848312,0.00008925);(59.012516,0.00850686);(59.207791,0.00005937);(59.525329,0.00004497);(59.912173,0.00006449);(60.112863,0.00006403);(60.417233,0.0000443);(61.414192,0.00005862);(61.986994,0.0253452);(62.077007,0.00004877);(62.486535,0.00003795);(63.03769,0.00009942);(63.723233,0.00005957);(63.961093,0.02209079);(64.069628,0.00006309);(64.269794,0.00004202);(64.286297,0.00004453);(64.301262,0.00004188);(64.719614,0.00006448);(65.050232,0.00004251);(65.34285,0.00005073);(65.6575,0.00009491);(65.896948,0.00004697);(65.956897,0.00027511);(66.527467,0.00005902);(66.957651,0.00006797);(67.755643,0.00003787);(67.835658,0.00003279);(68.576318,0.0000896);(68.758456,0.00006823);(69.142053,0.00006097);(69.322031,0.00003629);(69.644158,0.0000651);(69.948089,0.00004802);(70.88878,0.00004211);(71.012499,0.00151513);(71.087624,0.00005286);(71.643039,0.00007096);(71.752267,0.00006005);(72.062573,0.0000463);(72.316554,0.00009462);(73.012217,0.00007616);(73.028128,0.00077635);(73.628305,0.00007213);(74.007337,0.00006549);(74.219674,0.00005469);(74.325647,0.00004288);(74.471455,0.00007485);(74.486536,0.00004155);(74.547722,0.00003901);(74.95433,0.00005336);(75.392713,0.00007384);(75.607953,0.00004683);(75.712216,0.00003839);(76.001309,0.00003259);(76.05078,0.00003732);(76.430361,0.00007279);(76.499975,0.00003969);(77.001682,0.00004406);(77.299408,0.00007225);(77.860187,0.00004374);(78.262544,0.00005711);(78.791521,0.00005904);(78.927995,0.00003578);(78.984565,0.03501232);(79.955994,0.00682282);(79.983665,0.00004449);(80.114341,0.00006106);(80.118063,0.00006234);(80.277766,0.00003569);(80.669276,0.00003828);(80.963807,0.00037235);(80.980375,0.00076058);(81.287052,0.0000938);(81.329095,0.00004442);(82.052916,0.00007168);(82.255827,0.00009681);(82.619395,0.0000388);(83.012522,0.00331086);(83.056147,0.00005285);(83.213195,0.00004339);(83.472603,0.00006038);(83.881897,0.00003827);(83.982266,0.00007116);(84.987482,0.00003785);(85.028165,0.00014352);(85.466031,0.00005121);(85.47243,0.00005664);(85.890643,0.00003588);(86.457739,0.0001013);(86.727484,0.00006087);(87.007399,0.00049051);(87.043067,0.00005024);(87.304388,0.00003513);(87.475431,0.00005686);(87.987763,0.00003605);(89.023114,0.00073826);(89.041469,0.00086526);(89.245907,0.00006595);(89.548544,0.00004429);(89.580943,0.00005413);(89.60112,0.00004071);(89.741804,0.00006378);(90.965609,0.00006754);(91.021017,0.00004925);(91.251612,0.00006204);(92.312081,0.00005192);(93.777848,0.00005481);(94.979566,0.05858693);(95.292316,0.00006314);(95.527388,0.0000589);(95.867207,0.00003464);(95.950965,0.00037172);(95.982805,0.00011684);(96.918138,0.00005658);(96.958809,0.02009108);(96.97531,0.0015967);(97.336852,0.00006011);(98.165355,0.00006231);(98.765074,0.00006015);(98.95459,0.00024554);(99.431206,0.00004123);(99.699201,0.00004922);(99.92445,0.00014011);(100.390062,0.00006238);(100.932331,0.000677);(101.023116,0.00111892);(101.323177,0.00006646);(101.397388,0.00008271);(102.063798,0.00005645);(102.382774,0.00004585);(103.067548,0.00005407);(103.716261,0.00006341);(104.453886,0.00006969);(104.787138,0.00005572);(106.120914,0.00004117);(107.012659,0.00022274);(107.070927,0.00007333);(107.368995,0.00005163);(107.398112,0.00004685);(107.993958,0.0000478);(108.150866,0.00009144);(108.375816,0.00006998);(109.175106,0.00004421);(110.557625,0.00005017);(110.737326,0.00003864);(110.956724,0.00323093);(110.974477,0.00594253);(110.988164,0.00006347);(111.007389,0.0000479);(111.1297,0.00003934);(111.643855,0.00004564);(112.689263,0.00003934);(113.023041,0.00025382);(113.75468,0.00009686);(114.860802,0.00004988);(114.881341,0.00003739);(115.919467,0.00230295);(116.919814,0.00004197);(116.927232,0.0007719);(117.176865,0.00006981);(117.307037,0.00003679);(117.701517,0.00006835);(117.864296,0.0000681);(119.091785,0.00004954);(119.463955,0.00006574);(120.452132,0.00004702);(122.312451,0.0000569);(123.018364,0.00004572);(123.043869,0.00011181);(123.718136,0.00004709);(124.16328,0.00004077);(125.023226,0.04643975);(126.026501,0.00226142);(127.516878,0.00004953);(127.620394,0.00004136);(127.851961,0.00003665);(128.145772,0.00006863);(128.198881,0.00007795);(128.726555,0.00005442);(129.256177,0.00005751);(130.943039,0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| | LC-MS/MS | LC-ESI-QFT | Positive | medium | View Spectrum | 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| | LC-MS/MS | LC-ESI-QFT | Negative | high | View Spectrum | (50.021115,0.00018826);(50.422739,0.00028035);(50.559505,0.00035696);(50.627766,0.00026127);(51.05455,0.00040902);(51.292767,0.00042423);(51.610628,0.00021973);(52.16826,0.00027243);(52.448192,0.00021231);(52.67302,0.00022147);(53.000315,0.00046812);(53.375131,0.00017647);(53.955805,0.0002796);(54.893492,0.000324);(55.059023,0.00025346);(55.862329,0.00021891);(56.399272,0.00018823);(56.79527,0.00040869);(57.033226,0.00189559);(58.159738,0.00024757);(58.375301,0.00018625);(58.449397,0.00021618);(58.653611,0.00017088);(59.012465,0.02396452);(59.175172,0.00042477);(60.031456,0.00018141);(60.791497,0.00047234);(61.597462,0.00024163);(61.721438,0.00022162);(61.986985,0.06346833);(62.038186,0.00022202);(62.206429,0.00029659);(62.312325,0.00022909);(62.442879,0.00019711);(62.472471,0.00023927);(62.795632,0.00026748);(63.870143,0.00029413);(63.961095,0.06679674);(64.149236,0.00048022);(64.677245,0.00024718);(64.813208,0.00020624);(65.00193,0.00862411);(65.1715,0.00031971);(65.39751,0.00025229);(65.488136,0.00038589);(65.681709,0.00029354);(65.956719,0.00028424);(66.055113,0.00038397);(66.305227,0.00022762);(66.5168,0.00023882);(67.381134,0.00044408);(67.822658,0.00040184);(67.931096,0.00022934);(68.04138,0.00031191);(68.672162,0.0003605);(68.883769,0.00027694);(69.5825,0.00024351);(69.847436,0.00024346);(70.1802,0.0001906);(70.91158,0.00017598);(70.914137,0.00028993);(70.91645,0.00026999);(71.012565,0.000923);(72.223094,0.00019332);(72.24347,0.00028915);(72.499991,0.00019976);(72.69407,0.0004365);(73.013865,0.00047451);(73.028173,0.00129222);(73.498999,0.00018501);(73.518263,0.00025525);(73.632429,0.00029017);(73.934916,0.00029029);(75.355308,0.00044469);(76.965921,0.00026711);(77.160931,0.00036399);(77.71482,0.00036826);(78.378262,0.00019037);(78.414047,0.00030044);(78.430401,0.00022207);(78.968674,0.00021801);(78.984583,0.06513494);(79.437634,0.00045677);(79.462182,0.00029333);(79.956011,0.02890644);(79.958626,0.00032763);(80.036595,0.00038);(80.963799,0.00128864);(81.344112,0.00034849);(82.536801,0.00021726);(82.976107,0.00038111);(83.012495,0.02510374);(83.732813,0.00024247);(84.533987,0.00037414);(85.75441,0.0002136);(85.75773,0.00023633);(85.873799,0.0002149);(86.180905,0.00040158);(86.476873,0.00042036);(86.694549,0.0001769);(86.928169,0.00049144);(87.53923,0.000253);(87.946625,0.00035571);(88.289895,0.00024236);(89.04137,0.00084664);(89.229981,0.00023181);(89.384381,0.00021918);(91.318628,0.00021595);(91.498411,0.00023249);(91.623897,0.00028442);(91.642512,0.00038612);(91.828488,0.00024426);(92.252112,0.00036483);(94.221516,0.0002201);(94.856993,0.00023137);(94.979556,0.14426125);(95.950766,0.00025491);(96.958799,0.05425084);(96.975253,0.00214022);(97.991691,0.00035219);(99.924476,0.00067147);(99.967455,0.00030692);(100.665324,0.00029259);(100.792556,0.00022091);(100.932214,0.00121512);(101.022983,0.00081298);(101.707598,0.00035983);(101.77901,0.00027311);(102.157825,0.00029889);(102.922994,0.00024523);(105.020504,0.00024862);(106.959155,0.0002603);(106.965142,0.00021321);(107.012565,0.02219573);(108.02038,0.00066455);(109.732755,0.00027517);(110.956644,0.00511673);(110.974485,0.01069577);(112.127641,0.00020337);(114.715178,0.00022835);(115.689545,0.00031592);(115.91954,0.00542456);(116.927275,0.00101162);(117.052425,0.00024455);(117.223168,0.00022519);(117.915585,0.00036975);(119.565078,0.0004171);(119.724497,0.00028574);(120.448748,0.00043911);(121.44065,0.000255);(122.327554,0.00058932);(123.008402,0.00026627);(124.015378,0.00149179);(125.023209,0.16961261);(126.026524,0.00565368);(126.661517,0.00037777);(126.961422,0.00038672);(128.9522,0.00025131);(129.439405,0.00036979);(131.064108,0.0003559);(132.317778,0.00018537);(133.31451,0.00055376);(134.036161,0.05930045);(134.575934,0.00061897);(135.044095,0.01555928);(136.015466,0.0109621);(137.023157,0.00105683);(137.581251,0.00023123);(142.615122,0.00024886);(142.70623,0.0002949);(143.140372,0.00025059);(144.063461,0.00037296);(144.837021,0.00027971);(145.938084,0.00030585);(146.147286,0.00022534);(147.636065,0.00024278);(147.957926,0.00024834);(148.578398,0.00024883);(149.023298,0.00148058);(149.059752,0.03260808);(149.480617,0.00039372);(149.553569,0.00017827);(150.063601,0.0005157);(150.995759,0.00150204);(151.002581,0.24747779);(151.020288,0.00025722);(151.808778,0.0003058);(152.00571,0.01178871);(154.608407,0.00024747);(157.313784,0.00044089);(158.036332,0.01066278);(158.938211,0.00033261);(160.015515,0.00266216);(161.736731,0.00026475);(161.906853,0.00019434);(163.001857,0.00020458);(163.42931,0.00028536);(164.010525,0.22518512);(165.013367,0.00664193);(165.018845,0.00204918);(167.033771,0.0003);(167.764145,0.00026911);(169.575067,0.00029659);(170.738062,0.00039893);(170.800508,0.00024293);(171.294177,0.00026571);(171.461642,0.00025207);(173.023954,0.0003632);(173.059938,0.02089719);(174.031313,0.08389232);(175.002622,0.00595634);(175.039428,0.00434557);(176.792955,0.00023341);(177.018487,0.01812788);(177.44674,0.00045052);(178.997786,0.00018861);(179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| | LC-MS/MS | LC-ESI-QFT | Negative | high | View Spectrum | (50.008156,0.00072337);(50.173731,0.00049819);(50.956169,0.00058907);(51.060892,0.00061561);(51.598434,0.00051839);(51.645862,0.00072364);(51.833694,0.00040042);(52.081812,0.00100095);(52.355321,0.00049654);(52.716523,0.0004619);(53.011674,0.00057841);(53.273557,0.00062693);(53.891209,0.00091456);(54.759564,0.00111242);(54.987004,0.00051861);(55.040495,0.00037493);(55.372135,0.00077335);(55.375628,0.00066896);(55.46184,0.00099108);(56.721296,0.00080293);(56.7509,0.00066224);(57.033241,0.04478945);(57.416647,0.00055149);(57.786215,0.00058558);(58.17139,0.00074961);(58.214612,0.00120791);(58.396405,0.00053206);(58.423946,0.00081462);(58.458042,0.00039173);(58.702615,0.00091067);(58.825495,0.00087553);(59.012495,0.0489234);(59.185069,0.00059855);(59.606615,0.00057226);(59.938383,0.00062284);(60.032001,0.0004372);(60.17519,0.00066408);(60.458174,0.00058909);(61.597613,0.00067842);(61.752131,0.00080552);(61.785766,0.00049405);(61.799597,0.00094897);(61.881676,0.00090674);(61.987,0.13635728);(62.587999,0.00116472);(62.823426,0.00047544);(63.022692,0.01938909);(63.230647,0.00058541);(63.460755,0.000792);(63.750854,0.00047939);(63.961092,0.22212571);(64.521622,0.00058793);(64.938203,0.00048302);(65.001919,0.29771241);(65.117705,0.00044308);(65.702928,0.0004738);(65.956904,0.00151336);(66.005362,0.00275849);(66.182465,0.00072266);(67.324465,0.00047743);(67.625885,0.00046439);(68.371887,0.00042983);(68.529709,0.00069816);(68.896958,0.00065536);(69.010683,0.00059132);(69.111772,0.00040856);(70.054789,0.00085949);(70.60773,0.00061436);(70.691209,0.00075706);(70.803046,0.00054913);(70.87001,0.00041593);(71.012535,0.00329773);(71.456726,0.00051552);(71.84765,0.00041723);(71.910112,0.00058691);(72.368014,0.00040925);(73.282245,0.00080351);(73.709184,0.00075953);(74.548659,0.00051819);(74.989384,0.00069361);(76.175238,0.000619);(76.553227,0.00074029);(77.423183,0.00065383);(77.952063,0.00054178);(78.338283,0.00058724);(78.516693,0.00076258);(78.692517,0.00117222);(78.984593,0.05736296);(79.017875,0.00177774);(79.426417,0.00087373);(79.437138,0.0004827);(79.93768,0.00050684);(79.956031,0.19116132);(80.025443,0.0258172);(80.094611,0.00052857);(80.67124,0.00102117);(80.96387,0.00322078);(81.033285,0.00124588);(81.113388,0.00056308);(81.951944,0.00069182);(82.298334,0.00053495);(82.650559,0.00085304);(82.75902,0.0006026);(83.012533,0.21551497);(84.015819,0.00138776);(84.023599,0.00077801);(84.259049,0.0005361);(84.566691,0.000529);(84.907262,0.00087247);(85.028162,0.00051359);(85.510684,0.00113816);(86.107029,0.00222166);(87.704475,0.00070732);(88.701093,0.00048045);(88.998272,0.00052491);(89.636379,0.00052732);(89.837064,0.00065416);(91.424937,0.00061191);(91.994424,0.00067749);(93.033213,0.00099354);(94.979543,0.26158427);(95.012547,0.01229742);(95.933404,0.00055316);(95.951124,0.00087881);(96.14855,0.00054652);(96.260411,0.00068282);(96.406671,0.00110261);(96.463112,0.00040905);(96.698076,0.00057215);(96.958787,0.13617829);(96.975291,0.00266126);(97.301823,0.00044318);(97.375566,0.0006114);(97.744935,0.00085048);(97.787497,0.00113235);(98.096914,0.00091174);(98.927896,0.00097286);(98.954475,0.00167021);(99.924509,0.01657182);(100.073025,0.00099926);(100.287351,0.00128472);(100.931978,0.00207287);(101.605177,0.00067436);(102.075799,0.00065265);(103.572284,0.00043425);(103.608016,0.00079174);(104.253123,0.00070492);(105.004899,0.00066552);(106.565908,0.0005516);(107.012575,0.45717325);(108.016282,0.02646808);(108.020342,0.24251781);(108.215696,0.0005056);(109.023884,0.00502678);(109.028143,0.00409489);(110.560762,0.00050296);(110.91848,0.00076905);(110.956741,0.00306926);(110.974534,0.01771774);(111.007446,0.00236911);(111.592642,0.00055007);(112.548957,0.00067586);(114.282322,0.00046089);(115.91957,0.01293025);(116.927408,0.00296064);(117.412564,0.00049791);(117.588501,0.00108687);(117.794775,0.00057313);(117.855844,0.00066344);(118.287268,0.00077378);(119.012488,0.00046138);(120.020526,0.01460481);(120.542738,0.00102451);(120.947699,0.00057936);(121.028331,0.01122813);(121.119963,0.0007754);(121.668485,0.00053522);(122.000015,0.00043641);(123.007637,0.03855884);(123.044216,0.00055854);(123.175237,0.00078469);(124.011058,0.0005585);(124.015434,0.05868834);(125.023239,0.17127713);(125.958092,0.00058798);(125.991116,0.00096546);(126.045346,0.00050877);(126.692249,0.00069658);(129.378619,0.00061965);(129.437084,0.00046512);(132.020555,0.00140979);(133.02835,0.02241557);(134.03616,0.53925286);(135.007883,0.00307422);(135.039493,0.02814583);(135.044211,0.16465408);(136.015456,0.28750619);(136.047465,0.00474126);(137.018577,0.00497036);(137.023443,0.003379);(138.407078,0.00089692);(140.319418,0.00047769);(141.307042,0.00090425);(143.049483,0.00214517);(144.542481,0.00080508);(145.028373,0.00121322);(146.009258,0.0008119);(146.036363,0.00266301);(146.106828,0.00084973);(147.044219,0.00769184);(148.015228,0.00316221);(148.051878,0.00371189);(149.008179,0.00050092);(149.023361,0.01223272);(149.059806,0.03018016);(149.359369,0.0005445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| | LC-MS/MS | LC-ESI-QFT | Positive | high | View Spectrum | 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| | LC-MS/MS | LC-ESI-QFT | Positive | high | View Spectrum | 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| | LC-MS/MS | ESI- LC-Q-TOF/MS | Positive | low | View Spectrum | (71.0507,0.171);(85.0299,0.253);(129.0564,0.112);(153.0198,0.348);(177.056,0.259);(179.0358,0.065);(195.0307,0.103);(219.0307,0.046);(245.0454,0.042);(263.0567,0.062);(303.0877,0.999);(345.0984,0.064);(369.0991,0.04);(413.1249,0.069);(431.1354,0.074);(449.1454,0.171);(465.1396,0.115);(611.1976,0.062) | | LC-MS/MS | ESI- LC-Q-TOF/MS | Negative | low | View Spectrum | (151.0051,0.067);(164.0128,0.113);(242.0609,0.065);(286.0518,0.089);(301.0735,0.999);(609.1819,0.378) | | Predicted LC-MS/MS | Not Available | Positive | low | View Spectrum | (27.0234751,0.7879671338);(87.04460446,0.7086154759);(123.0446045,0.8385350424);(125.0602545,0.6438887677);(145.0500838,0.5594659308);(147.0657338,3.069656099);(149.0602545,1.515028808);(151.0759046,1.785064734);(153.0187836,1.352649637);(165.0762985,0.5996507409);(167.0708192,1.039083435);(177.0762985,0.7081941687);(219.0868632,0.6428992553);(249.0974279,1.001788054);(285.0762985,1.81707731);(285.0762985,9.048248814);(287.0555631,1.278663118);(287.0919486,1.186297493);(301.0712131,0.5086642414);(303.0868632,26.77297668);(309.1185573,1.924201606);(327.1291219,0.5095388427);(433.1346012,1.35690143);(447.1291219,3.978262741);(459.1138658,0.5190648041);(461.1295159,2.533756741);(465.1396866,2.234400744);(575.1764661,1.370380054);(579.1713807,0.5494491059);(593.1870307,16.2658845);(611.1975954,12.89374449) | | Predicted LC-MS/MS | Not Available | Positive | med | View Spectrum | (45.03403978,0.9297125755);(123.0446045,0.7763861973);(125.0602545,0.7375468723);(129.0551691,1.362026654);(137.023869,5.720490849);(145.0500838,0.5682843319);(147.0657338,4.194230046);(149.0602545,1.129251806);(151.0759046,1.914681172);(153.0187836,3.587850652);(153.0551691,0.7931576026);(163.0606485,1.791987201);(165.0762985,1.201173379);(177.0551691,0.9486422245);(271.0606485,0.7610072962);(273.0762985,5.360787912);(285.0762985,13.49327746);(285.0762985,3.485299455);(287.0555631,3.029006374);(287.0919486,0.6370172363);(291.1079926,0.5770504649);(299.0766924,0.939151075);(301.0712131,1.294243839);(303.0868632,31.78194684);(309.1185573,1.33978074);(447.1291219,4.193002974);(461.1295159,0.5439685266);(465.1396866,2.930166468);(575.1764661,0.614042596);(593.1870307,2.535385119);(611.1975954,0.8294440602) | | Predicted LC-MS/MS | Not Available | Positive | high | View Spectrum | (45.03403978,1.977004939);(75.04460446,1.375694521);(77.03912516,1.020450244);(87.04460446,1.077055074);(123.0446045,6.2070101);(131.0708192,1.362072705);(137.023869,3.51281174);(145.0500838,1.665437752);(147.0657338,3.384098087);(149.0602545,4.833965988);(151.0759046,4.528962273);(153.0187836,9.13064836);(153.0551691,1.186227174);(155.0344337,2.655044768);(161.0449984,1.402302152);(161.0813839,1.205283152);(163.0606485,5.708143245);(167.0708192,2.855452743);(177.0551691,1.036172105);(193.0500838,1.201081704);(271.0817778,2.54176853);(285.0762985,5.2076287);(285.0762985,3.957540234);(287.0555631,3.831288124);(287.0766924,1.919425545);(287.0919486,1.619736358);(303.0868632,15.5521844);(313.0923425,2.443860195);(447.1291219,1.074233643);(549.160816,1.488744983);(593.1870307,3.038670462) | | Predicted LC-MS/MS | Not Available | Negative | low | View Spectrum | (56.99765427,2.811892564);(57.03403978,1.110002677);(59.01330434,0.9725078729);(73.0289544,1.972971157);(87.00821896,2.609625508);(87.04460446,2.053585165);(89.02386902,1.079757735);(101.023869,1.019331044);(117.0551691,1.259667841);(123.0446045,1.296737034);(145.0500838,4.347614781);(163.0606485,6.871716261);(219.0868632,0.7901500654);(235.0817778,1.439650847);(249.0974279,2.091610792);(279.1079926,1.757054732);(283.0606485,3.052758904);(285.039913,1.952197499);(295.1029072,1.027770452);(301.0712131,17.76628321);(307.1029072,0.9708137354);(325.1134719,0.8412910316);(343.0817778,1.301545738);(431.1189512,1.850689434);(445.1134719,2.130179767);(463.1240366,5.050470019);(505.1346012,1.142840414);(521.1295159,1.441354284);(523.1451659,0.7733062202);(591.1713807,6.686638659);(609.1819454,20.52798456) | | Predicted LC-MS/MS | Not Available | Negative | med | View Spectrum | (43.01838972,2.90426429);(59.01330434,2.078271089);(71.01330434,0.8812483883);(73.0289544,1.307416149);(87.00821896,1.342912989);(87.04460446,1.132271374);(89.02386902,4.472415678);(133.0500838,1.04310174);(145.0500838,10.84183794);(151.0031336,0.9190166826);(161.0449984,1.142920669);(163.0606485,9.802960734);(259.0606485,1.532669746);(269.0449984,1.361310291);(271.0606485,1.062878264);(279.1079926,0.9735442303);(283.0606485,2.119358555);(285.039913,10.5573093);(301.0712131,24.12798741);(307.1029072,1.531989208);(313.0712131,0.9417103731);(325.1134719,1.217662455);(343.0817778,1.205132134);(359.0766924,0.8310095429);(431.1189512,1.087455164);(445.1134719,1.475033612);(447.0927364,0.9619290723);(463.1240366,1.549773975);(591.1713807,6.195159656);(593.1506452,1.247926089);(609.1819454,2.151523194) | | Predicted LC-MS/MS | Not Available | Negative | high | View Spectrum | (41.00273965,1.456501861);(43.01838972,3.204593978);(55.01838972,1.633265754);(57.03403978,1.775427861);(59.01330434,2.697753572);(73.0289544,2.061507818);(85.0289544,1.108399651);(103.0395191,0.777858742);(123.0446045,2.259959233);(135.008219,0.8352958462);(145.0500838,2.814433148);(147.0446045,1.090553874);(149.023869,1.460784482);(149.0602545,2.746323158);(151.0031336,1.020104923);(163.0606485,8.323407227);(165.0551691,1.007433662);(177.0187836,0.7886266605);(187.0606485,0.8184115727);(231.0657338,1.299571441);(255.0293483,0.9746908575);(257.0449984,2.17517464);(259.0606485,2.613377986);(269.0449984,3.235705816);(271.0606485,1.558487086);(283.0606485,1.189596633);(283.0606485,2.14293365);(285.039913,15.14144262);(299.0555631,1.751157231);(301.0712131,29.27888835);(519.1502513,0.7583306593) |
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