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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1-methyladenosine1-MethyladenosineME630628--7.65282.1193
1-methylguanosine1-MethylguanosineME630629--5.06298.114
1-methylhistamine1-MethylhistamineME630630--9.54126.1028
1-methylnicotinamide1-Methyl nicotinamideME630631--8.2137.0708
21-deoxycortisol21-DeoxycortisolME630632--2.01347.221
2'-deoxyadenosineDeoxyadenosineME630633--5.18252.1087
2'-deoxycytidineDeoxycytidineME630634--5.97228.0969
3-methylhistamine3-MethylhistamineME630635--9.77126.1028
3-methylhistidine3-MethylhistidineME630636--9.77170.0917
4-guanidinobutanoate4-Guanidinobutanoic acidME630637--7.27146.0921
4-pyridoxate4-Pyridoxic acidME630638--4.08184.0595
5-hydroxytryptophol5-HydroxytryptopholME630639--1.83178.0854
5-methylcytidine5-MethylcytidineME630640--5.99258.1082
5-methylcytosine5-MethylcytosineME630641--6.09126.0663
7-methylguanine7-MethylguanineME630642--5.74166.0717
acetylcholineAcetylcholineME630643--7.73146.1172
acisogaAcisogaME630644--5.61185.1275
adenosineAdenosineME630645--4.99268.1037
ADMADimethylarginineME630646--9.71203.1493
ala-alaAla-AlaME630647--7.99161.0915
alanineAlanineME630648--7.7890.0551
allantoinAllantoinME630649--3.61159.0508
alpha-glycerophosphocholinesn-Glycero-3-phosphocholineME630650--10.4258.1098
anserineAnserineME630651--10.45241.1287
arachidoyl ethanolamideEicosanoyl-EAME630652--1.99356.3515
arginineArginineME630653--9.1175.1181
asparagineAsparagineME630654--7.88133.0608
aspartateAspartic acidME630655--7.89134.0448
beta-guanidinopropionate3-Guanidinopropanoic acidME630656--7.46132.0768
betaineBetaineME630657--8.96118.0865
biliverdinBiliverdinME630658--1.95583.254
butyrobetaine3-DehydroxycarnitineME630659--8.78146.1172
C10 carnitineCAR 10:0ME630672--7.08316.2475
C12:1 carnitineCAR 12:1ME630674--6.93342.2631
C12 carnitineCAR 12:0ME630673--6.89344.2788
C14:0 LPCLPC 14:0ME630783--7.84468.3078
C14:0 SMSM 18:1;O2/14:0ME630832--7.22675.5392
C14:1 carnitineCAR 14:1ME630676--6.74370.2944
C14:2 carnitineCAR 14:2ME630677--6.8368.2787
C14 carnitineCAR 14:0ME630675--6.74372.31
C16:0 Ceramide (d18:1)Cer 18:1;O2/16:0ME630842--1.86538.5197
C16:0 LPCLPC 16:0ME630785--7.69496.3395
C16:0 LPELPE 16:0ME630800--6.25454.2923
C16:0 SMSM 18:1;O2/16:0ME630834--7.13703.5707
C16:1 LPCLPC 16:1ME630784--7.76494.3239
C16:1 LPC plasmalogenLPC P-16:1 or LPC O-16:2ME630797--7.49480.3445
C16:1 SMSM 18:1;O2/16:1ME630833--7.14701.5553
C16 carnitineCAR 16:0ME630678--6.62400.3413
C16-OH carnitineCAR 16:0;OHME630679--7.06416.3363
C18:0 LPCLPC 18:0ME630789--7.58524.3712
C18:0 LPE ALPE 18:0ME630804--6.18482.324
C18:0 LPE BLPE 18:0ME630805--7.76482.3241
C18:0 SMSM 18:1;O2/18:0ME630836--7.05731.6027
C18:1 carnitineCAR 18:1ME630681--6.53426.357
C18:1 LPCLPC 18:1ME630788--7.62522.356
C18:1 LPC plasmalogen ALPC P-18:0 or LPC O-18:1ME630798--7.4508.3761
C18:1 LPC plasmalogen BLPC P-18:0 or LPC O-18:1ME630799--7.73508.3759
C18:1 LPELPE 18:1ME630803--6.2480.3083
C18:1-OH carnitineCAR 18:1;OHME630682--6.99442.3521
C18:1 SMSM 18:1;O2/18:1ME630835--7.06729.5871
C18:2 carnitineCAR 18:2ME630683--6.59424.3413
C18:2 LPCLPC 18:2ME630787--7.58520.3398
C18:2 LPELPE 18:2ME630802--6.16478.2925
C18:3 LPCLPC 18:3ME630786--7.69518.3215
C18:3 LPELPE 18:3ME630801--6.24476.2743
C18 carnitineCAR 18:0ME630680--6.51428.3727
C20:0 LPELPE 20:0ME630807--7.63510.3553
C20:0 SMSM 18:1;O2/20:0ME630837--6.99759.6319
C20:1 LPCLPC 20:1ME630793--7.4550.3874
C20:3 LPCLPC 20:3ME630792--7.46546.3562
C20:4 carnitineCAR 20:4ME630685--6.49448.3413
C20:4 LPC ALPC 20:4ME630790--7.61544.3401
C20:4 LPC BLPC 20:4ME630791--7.47544.3402
C20:4 LPELPE 20:4ME630806--6.1502.2927
C20 carnitineCAR 20:0ME630684--6.4456.4042
C22:0 SMSM 18:1;O2/22:0ME630838--6.93787.6633
C22:4 LPCLPC 22:4ME630796--7.4572.3636
C22:5 LPCLPC 22:5ME630795--7.4570.3542
C22:6 LPCLPC 22:6ME630794--7.43568.3378
C24:1 ceramide (d18:1)Cer 18:1;O2/24:1ME630843--1.81648.6257
C2 carnitineCAR 2:0ME630662--8.69204.122
C30:0 PCPC 30:0ME630808--6.62706.5344
C32:2 PCPC 32:2ME630809--6.59730.5352
C34:0 PEPE 34:0ME630819--6.61720.5502
C34:1 DAGDG 34:1ME630844--1.59612.5533
C34:2 PEPE 34:2ME630818--5.47716.5189
C34:2 PE plasmalogenPE P-34:1 or PE O-34:2ME630826--5.42702.5393
C34:3 PCPC 34:3ME630811--6.53756.5473
C34:3 PC plasmalogenPC P-34:2 or PC O-34:3ME630813--6.51742.571
C34:3 PE plasmalogenPE P-34:2 or PE O-34:3ME630825--5.43700.5236
C34:4 PCPC 34:4ME630810--6.52754.5329
C36:2 PCPC 36:2ME630812--6.51786.595
C36:2 PEPE 36:2ME630821--5.44744.5507
C36:3 PE plasmalogenPE P-36:2 or PE O-36:3ME630815--5.4728.5554
C36:4 PEPE 36:4ME630820--5.4740.5192
C36:5 PC plasmalogenPC P-36:4 or PC O-36:5ME630814--6.42766.5693
C36:5 PE plasmalogenPE P-36:4 or PE O-36:5ME630827--5.35724.5241
C38:4 PEPE 38:4ME630823--5.37768.5472
C38:5 PE plasmalogenPE P-38:4 or PE O-38:5ME630830--5.38752.5529
C38:6 PC plasmalogenPC P-38:5 or PC O-38:6ME630817--6.38792.5854
C38:6 PEPE 38:6ME630822--5.38764.5169
C38:6 PE plasmalogenPE P-38:5 or PE O-38:6ME630829--5.32750.5375
C38:7 PC plasmalogenPC P-38:6 or PC O-38:7ME630816--6.39790.5696
C38:7 PE plasmalogenPE P-38:6 or PE O-38:7ME630828--5.33748.522
C3 carnitineCAR 3:0ME630663--8.35218.1378
C3-DC carnitineCAR DC3:0ME630664--9.49248.1124
C3-DC-CH3 carnitineCAR 3:0;2MeME630665--8.58262.1283
C40:6 PEPE 40:6ME630824--5.34792.5486
C40:7 PE plasmalogenPE P-40:6 or PE O-40:7ME630831--5.29776.5537
C4 carnitineCAR 4:0ME630666--8232.1536
C4-OH carnitineCAR 4:0;OHME630667--8.86248.1487
C5 carnitineCAR 5:0ME630668--7.76246.1695
C6 carnitineCAR 6:0ME630669--7.56260.1853
C7 carnitineCAR 7:0ME630670--7.4274.201
C8 carnitineCAR 8:0ME630671--7.3288.2166
cadaverineCadaverineME630686--9.28103.1232
carnitineCarnitineME630661--8.83162.1118
C-glycosyltryptophanC-GlycosyltryptophanME630687--7.07367.149
cholineCholineME630688--8.24104.1071
creatineCreatineME630689--8.3132.0768
creatinineCreatinineME630690--6.43114.0665
cyclohexylamineCyclohexylamineME630691--6.38100.1122
cytidineCytidineME630692--5.83244.0923
diacetylspermineN1,N12-DiacetylspermineME630693--10.29287.2438
dimethylglycineDimethylglycineME630694--8.51104.0708
ectoineEctoineME630695--8.88143.0812
glutamateGlutamic acidME630696--7.62148.0601
glutamineGlutamineME630697--8147.076
glutathione reducedGlutathioneME630698--7.87308.0905
glycineGlycineME630699--7.8976.0394
guanidinoacetateGuanidoacetic acidME630700--7.85118.0614
guanosineGuanosineME630701--5.26284.0985
hippurateHippuric acidME630702--2.64180.0647
histamineHistamineME630703--9.14112.0872
histidineHistidineME630704--9.19156.0763
homoarginineHomoarginineME630705--9.14189.1336
hydroxyprolineHydroxyprolineME630706--7.87132.0656
hypotaurineHypotaurineME630707--7.97110.0273
imidazoleacetateImidazoleacetic acidME630709--8.05127.0504
imidazole propionateImidazole propanoateME630708--7.43141.0656
inosineInosineME630710--4.88269.0877
isoleucineIsoleucineME630711--7.06132.1019
kynurenateKynurenic acidME630712--5.25190.0488
L-alpha-glutamyl-L-LysineGlu-LysME630713--9.66276.1549
leucineLeucineME630714--6.93132.1019
linoleoyl ethanolamideLinoleoyl-EAME630715--1.99324.289
lysineLysineME630716--9.33147.1124
methionineMethionineME630717--7.01150.0579
methionine sulfoxideMethionine sulfoxideME630718--8.6166.0526
methylguanidineMethylguanidineME630720--6.7474.0713
methylimidazoleacetateMethylimidazoleacetic acidME630721--8.87141.0657
methyl N-methylanthranilateMethyl N-methylanthranilateME630719--1.99166.0856
methylthioadenosineMethylthioadenosineME630722--4.18298.0963
myristoleateMyristoleic acidME630723--1.69227.1997
N1-acetylspermidineN1-AcetylspermidineME630724--9.7188.1748
N1-acetylspermineN1-AcetylspermineME630725--11.02245.2331
N1-methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME630726--4.3153.0654
N2,N2-dimethylguanosineN2,N2-DimethylguanosineME630727--5.33312.1296
N4-acetylcytidineN4-AcetylcytidineME630728--4.28286.1029
N6-acetyllysineN6-AcetyllysineME630731--8.36189.1223
N6-methyllysineN(6)-MethyllysineME630732--9.96161.1279
N6,N6-dimethyllysineN(6),N(6)-Dimethyl-lysineME630730--10.2175.1433
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME630729--11.18189.1587
N-acetylalanineN-AcetylalanineME630733--3.94132.0656
N-acetylaspartateN-Acetylaspartic acidME630734--4.61176.0545
N-acetylgalactosamineN-Acetyl-D-galactosamineME630660--5.49222.0962
N-acetylglutamineN-AcetylglutamineME630735--7.06189.0859
N-acetylhistamineN-AcetylhistamineME630736--7.69154.097
N-acetylhistidineN-AcetylhistidineME630737--8.45198.0862
N-acetylleucineN-AcetylleucineME630738--2.92174.1117
N-acetylmethionineN-AcetylmethionineME630739--3.48192.068
N-acetylornithineN-AcetylornithineME630740--8.38175.1069
N-acetylphenylalanineN-AcetylphenylalanineME630741--3.25208.0958
N-acetylputrescineN-AcetylputrescineME630742--7.89131.118
N-acetyltryptophanN-Acetyl-tryptophanME630743--2.97247.1072
N-alpha-acetylargininePelargonidinME630744--8.16217.1286
N-carbamoyl-beta-alanineUreidopropionic acidME630745--4.06133.0608
niacinamideNiacinamideME630746--3.73123.0557
N-lauroylglycineNAGly 12:0ME630747--2.39258.2061
N-methylprolineN-Methyl-prolineME630748--8.6130.0864
NMMATarginineME630749--9.37189.1336
oleoyl glycineNAGly 18:1(9Z)ME630750--1.84340.2838
ornithineOrnithineME630751--9.21133.0972
pantothenatePantothenic acidME630752--3.11220.117
pantothenolPantothenolME630753--3.8206.1377
phenylacetylglycinePhenylacetylglycineME630754--2.85194.0801
phenylalaninePhenylalanineME630755--6.68166.0856
phenylalanine-d8PhenylalanineME630626--6.69174.1357
phosphocholineCholine phosphateME630756--10.74184.0723
phytosphingosinePhytosphingosineME630840--5.83318.2996
pipecolatePipecolic acidME630757--7.96130.0863
pro-glyPro-GlyME630758--8.45173.0913
prolineProlineME630759--8.09116.0709
proline-betaineProline betaineME630760--9.21144.1016
pseudouridinePseudouridineME630761--4.01245.0764
pterinPterinME630762--4.74164.0561
putrescinePutrescineME630763--9.3189.1074
S-adenosylhomocysteineS-AdenosylhomocysteineME630764--8.09385.1281
S-adenosylmethionineS-AdenosylmethionineME630765--10.08399.1437
SDMASymmetric dimethylarginineME630766--9.59203.1493
serineSerineME630767--7.64106.0501
serotoninSerotoninME630768--6.23177.1014
S-methyl-L-cysteine-S-oxideS-Methylcysteine S-oxideME630769--8.6152.0382
sphinganineSphinganineME630841--5.73302.3047
sphingosineSphingosineME630839--5.71300.2891
taurineTaurineME630770--6.09126.0222
thiamineThiamineME630771--9.66265.1115
threonineThreonineME630772--7.58120.066
trigonellineTrigonellineME630773--8.86138.0548
trimethylamine-N-oxideTrimethylamine N-oxideME630774--8.1276.0757
tryptophanTryptophanME630775--6.47205.0961
tyrosineTyrosineME630776--6.78182.0802
urateUric acidME630777--4.31169.0349
urocanateUrocanic acidME630778--4.55139.05
valineValineME630779--7.38118.0866
valine-d8ValineME630627--7.4126.1367
warfarinWarfarinME630780--1.72309.1117
xanthineXanthineME630781--3.77153.0403
xanthosineXanthosineME630782--4.25285.0826


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