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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
xyluloseXyluloseME137444--553450173
xyloseXyloseME137445--546699307
xylonolactoneD-Xylono-1,5-lactoneME137446--535176217
xylonic acid isomer-ME137447--590775189
xylitolXylitolME137448--567437217
xanthosineXanthosineME137449--926133325
xanthineXanthineME137450--701688353
valineValineME137451--313502144
uridineUridineME137452--861508217
uric acidUric acidME137453--731038441
ureaUreaME137454--336356189
uracilUracilME137455--385735241
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME137456--625003226
UDP-glucuronic acidUDP-glucuronic acidME137457--585473217
UDP GlcNAcUDP-N-acetylglucosamineME137458--627437226
tyrosineTyrosineME137459--671252218
tryptophanTryptophanME137460--780482202
trans-4-hydroxyprolinetrans-4-HydroxyprolineME137461--460662158
tocopherol gammagamma-TocopherolME137462--1026121223
tocopherol alphaalpha-TocopherolME137463--1067809237
thymidineThymidineME137464--349402170
threonineThreonineME137465--409568218
threonic acidThreonic acidME137466--497572292
threitolThreitolME137467--467595217
taurineTaurineME137468--556690326
tartaric acidTartaric acidME137469--532135292
sulfuric acidTG 16:0_18:1_18:1ME137470--285430227
sucroseSucroseME137471--912704271
succinic acidSuccinic acidME137472--370737247
succinate semialdehydeSuccinic acid semialdehydeME137473--297024113
stearic acidStearic acidME137474--787622117
squaleneSqualeneME137475--97623795
spermidineSpermidineME137476--774747174
sorbitolSorbitolME137477--667922217
shikimic acidShikimic acidME137478--611100204
serineSerineME137479--395020218
sebacic acid, di(2-octyl) ester-ME137480--968699185
ribulose-5-phosphateRibulose 5-phosphateME137481--735908357
ribose-5-phosphateRibose 5-phosphateME137482--731096315
riboseRiboseME137483--553135217
ribonic acidRibonic acidME137484--597646292
ribitolRibitolME137485--575497217
raffinoseRaffinoseME137486--1120886361
pyruvic acidPyruvic acidME137487--213805174
pyrophosphatePyrophosphateME137488--327517110
putrescinePutrescineME137489--588872174
p-tolyl glucuronideP-Cresol glucuronideME137490--847531180
pseudo uridinePseudouridineME137491--813899217
propane-1,3-diol NISTPropane-1,3-diolME137492--214380177
prolineProlineME137493--364716142
pipecolinic acidPipecolic acidME137494--404121156
phthalic acidPhthalic acidME137495--567345147
phosphogluconic acidPhosphogluconic acidME137496--847013299
phosphoethanolaminePhosphoethanolamineME137497--603912299
phosphoenolpyruvatePhosphoenolpyruvic acidME137498--518184211
phosphatePhosphoric acidME137499--345365314
phenylethylaminePhenylethylamineME137500--510327174
phenylalaninePhenylalanineME137501--537804218
phenaceturic acidPhenylacetylglycineME137502--65435191
pentono-1,4-lactoneRibonolactoneME137503--587644102
pelargonic acidPelargonic acidME137504--399229117
parabanic acidParabanic acidME137505--464991100
pantothenic acidPantothenic acidME137506--690887291
palmitoleic acidPalmitoleic acidME137507--704511311
palmitic acidPalmitic acidME137508--713809313
oxoprolineOxoprolineME137509--485935156
oxalic acidOxalic acidME137510--260513190
orotic acidOrotic acidME137511--586317254
ornithineOrnithineME137512--529384142
oleic acidOleic acidME137513--779120339
octanoln-OctanolME137514--247010187
octadecanolStearyl alcoholME137515--755409327
nonadecanoic acidNonadecylic acidME137516--822782117
N-methylalanineN-MethylalanineME137517--286855130
nicotinic acidNicotinic acidME137518--353934180
nicotinamideNiacinamideME137519--471602179
N-acetylmannosamineN-Acetyl-mannosamineME137520--722897319
N-acetylglutamateN-Acetylglutamic acidME137521--604748216
n-acetyl-d-hexosamineN-AcetylhexosamineME137522--746341319
myristic acidMyristic acidME137523--634414117
methyltetrahydrophenanthrenone-ME137524--594337197
methionine sulfoxideMethionine sulfoxideME137525--605401128
methionineMethionineME137526--483560176
methanolphosphateMethanolphosphateME137527--289520241
melibioseMelibioseME137528--988497361
melezitoseMelezitoseME137529--1146704361
mannoseMannoseME137530--645856205
maltotrioseMaltotrioseME137531--1176044361
maltoseMaltoseME137532--946601204
malic acidMalic acidME137533--463180233
maleimideMaleimideME137534--245118154
maleic acidMaleic acidME137535--363611245
lyxitolL-ArabitolME137536--573587217
lysineLysineME137537--663483156
linolenic acidOctadecatrienoic acidME137538--780376108
linoleic acidLinoleic acidME137539--777414150
levoglucosanGlucosanME137540--569637204
leucineLeucineME137541--346101158
lauric acidLauric acidME137542--547906117
lactoseLactoseME137543--935640191
lactitolLactitolME137544--959541361
lactic acidLactic acidME137545--215238191
isothreonic acidD-Threonic acidME137546--489385292
isomaltoseIsomaltoseME137547--993307204
isoleucineIsoleucineME137548--359251158
isocitric acidIsocitric acidME137549--616323245
inositol-4-monophosphateInositol 4-phosphateME137550--846510315
inosine-5'-monophosphateIMPME137551--1018687169
inosineInosineME137552--897184230
indole-3-lactateIndolelactic acidME137553--764586202
indole-3-acetateIndoleacetic acidME137554--684929202
hypoxanthineHypoxanthineME137555--619128265
hydroxylamineHydroxylamineME137556--253158146
hydroxycarbamateHydroxycarbamic acidME137557--325948278
histidineHistidineME137558--664395154
hexuronic acidHexuronic acidME137559--667373160
hexose-6-phosphateHexose 6-phosphateME137560--806282387
hexonic acidGluconic acidME137561--698302217
hexitolSorbitolME137562--704741217
hexadecylglycerolMG O-16:0ME137563--867593205
heptadecanoic acidMargaric acidME137564--751309117
guanosineGuanosineME137565--954962324
glycolic acidGlycolic acidME137566--227215177
glycocyamineGuanidoacetic acidME137567--511016171
glycineGlycineME137568--368707248
glycerol-alpha-phosphatesn-Glycero-3-phosphateME137569--590747357
glycerol-3-galactosideGalactosylglycerolME137570--800205204
glycerolGlycerolME137571--344466205
glyceric acidGlyceric acidME137572--377495189
glutathioneGlutathioneME137573--761296213
glutaric acidGlutaric acidME137574--421596261
glutamine dehydratedGlutamineME137575--519033227
glutamineGlutamineME137576--600315156
glutamic acidGlutamic acidME137577--529100246
glutamateGlutamic acidME137578--489240174
glucose-6-phosphateGlucose 6-phosphateME137579--818275387
glucose-1-phosphateGlucose 1-phosphateME137580--594647217
glucoseGlucoseME137581--659798319
gluconic acidGluconic acidME137582--693148333
glucoheptuloseGlucoheptuloseME137583--828606217
gamma-aminobutyric acidgamma-Aminobutyric acidME137584--364801102
galactose-6-phosphateGalactose 6-phosphateME137585--828102387
galactonic acidGalactonic acidME137586--690882292
galactinolGalactinolME137587--1017580204
fumaric acidFumaric acidME137588--392338245
fucoseFucoseME137589--578299160
fructose-6-phosphateFructose 6-phosphateME137590--804279315
fructose-1-phosphateFructose 1-phosphateME137591--803180387
fructoseFructoseME137592--641863307
ethanolamineEthanolamineME137593--340131174
ethanol phosphateEthylphosphateME137594--317291211
erythronic acid lactoneErythrono-1,4-lactoneME137595--407495247
erythritolErythritolME137596--471922217
enolpyruvatePhosphoenolpyruvic acidME137597--234394217
dodecanolDodecanolME137598--507619243
dodecanoic acid, isopropanol ester-ME137599--536494200
doconexentDHAME137600--90281991
digalacturonic acidDigalacturonic acidME137601--988150169
dehydroascorbic acidL-Dehydroascorbic acidME137602--641371303
cytidine-5-monophosphateCMPME137603--974825169
cystineCystineME137604--804619218
cysteine-glycineCys-GlyME137605--715335220
cysteineCysteineME137606--500158220
creatinineCreatinineME137607--502599115
conduritol-beta-expoxideConduritol epoxideME137608--701723318
citrullineCitrullineME137609--623406157
citric acidCitric acidME137610--617342273
citramalic acidCitramalic acidME137611--456203247
cis-gondoic acidcis-Gondoic acidME137612--847372367
cholesterolCholesterolME137613--1078536129
cholestan-3-olEpi-cholestanolME137614--1082070215
cellobioseCellobioseME137615--932179204
capric acidCapric acidME137616--452386229
bisphosphoglycerol-ME137617--764660299
beta-glycerolphosphatesn-Glycero-2-phosphateME137618--574470243
beta-glutamic acidIsoglutamic acidME137619--525547232
beta-alaninebeta-AlanineME137620--435564248
benzoic acidBenzoic acidME137621--339067179
behenic acidBehenic acidME137622--920648117
aspartic acidAspartic acidME137623--480387232
aspartateAspartic acidME137624--433075160
asparagineAsparagineME137625--553078188
ascorbic acidVitamin CME137626--672898332
arachidonic acidArachidonic acidME137627--83711591
arachidic acidArachidic acidME137628--856421117
aminomalonateAminomalonic acidME137629--455754218
allantoic acid dehydrated-ME137630--723539259
alanine-alanineAla-AlaME137631--523110116
alanineAlanineME137632--244189116
adipic acidAdipic acidME137633--474435111
adenosine-5-monophosphateAMPME137634--1038688169
adenosineAdenosineME137635--918039236
adenineAdenineME137636--646534264
aconitic acidcis-Aconitic acidME137637--586815229
97455 maybe EPA-ME137638--84076493
5-methoxytryptamine5-MethoxytryptamineME137639--864466174
5-hydroxy-3-indoleacetic acid5-Hydroxyindoleacetic acidME137640--777606290
5'-deoxy-5'-methylthioadenosine5'-MethylthioadenosineME137641--967036236
4-hydroxyhippuric acid4-Hydroxyhippuric acidME137642--784581294
4-hydroxybutyric acid4-Hydroxybutyric acidME137643--325027233
4-aminobutyric acid4-Aminopentanoic acidME137644--488730304
41682 acc mass = ketodeoxyhexonate-ME137645--605091144
3-phosphoglycerate3-Phosphoglyceric acidME137646--610734227
3-hydroxybutyric acid3-Hydroxybutyric acidME137647--278829191
3,6-anhydro-D-galactose3,6-Anhydro-galactoseME137648--588886231
2-monopalmitinMG 0:0/16:0/0:0ME137649--890356129
2-monooleinMG 0:0/18:1(9Z)/0:0ME137650--941794129
2-hydroxyvaleric acid2-Hydroxyvaleric acidME137651--309587131
2-hydroxyglutaric acid2-Hydroxyglutaric acidME137652--506306247
2-hydroxybutanoic acid2-Hydroxybutyric acidME137653--258161131
2-deoxytetronic acid3,4-Dihydroxybutyric acidME137654--433456189
21683 glycerol-1-phosphate byproduct-ME137655--524126211
2,3-dihydroxybutanoic acid2,3-Dihydroxybutanoic acidME137656--384796292
1-monostearinMG 18:0/0:0/0:0ME137657--959214129
1-monopalmitinMG 16:0/0:0/0:0ME137658--901749129
1-kestose1-KestoseME137659--1123027361
1,5-anhydroglucitol1,5-AnhydrosorbitolME137660--633969217
2,5-dihydroxypyrazine2,5-DihydroxypyrazineME137661--397526241


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