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Analysis: GC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,5-anhydroglucitol1,5-AnhydrosorbitolME38774864960C07326633603217
1-hexadecanolCetyl alcoholME3877512682C00823679596299
1-monopalmitinMG 16:0/0:0/0:0ME38775014900C01885901749129
1-monostearinMG 18:0/0:0/0:0ME38774924699D01947959214203
2,3-dihydroxybutanoic acid2,3-Dihydroxybutanoic acidME387743250402-384796292
2,5-dihydroxypyrazine2,5-DihydroxypyrazineME38774223368901-397526241
2-aminobutyric acid2-Aminobutyric acidME3877476657C02721286855130
2-deoxytetronic acid3,4-Dihydroxybutyric acidME387746192742-390517117
2-hydroxybutanoic acid2-Hydroxybutyric acidME387745440864C05984258161131
2-monooleinMG 0:0/18:1(9Z)/0:0ME3877445319879-941794129
3-hydroxybutyric acid3-Hydroxybutyric acidME38774192135C01089278829191
4-methylbenzenesulfonamideToluene-4-sulfonamideME3877406269C14412609097228
acetophenoneAcetophenoneME3877397410C07113238615105
adenosineAdenosineME38773860961C00212918039236
adenosine-5-monophosphateAMPME3877376083C000201038688169
alanineAlanineME3877365950C00041243971116
allantoic acidAllantoic acidME387735203C00499723539259
alpha-aminoadipic acidalpha-Aminoadipic acidME38773492136C00956573295260
aminomalonateAminomalonic acidME387733100714C00872455754218
arachidonic acidArachidonic acidME387732444899C0021983711591
aspartic acidAspartic acidME3877315960C00049480387232
beta-alaninebeta-AlanineME387730239C00099435564248
beta-glycerolphosphatesn-Glycero-2-phosphateME3877292526C02979574470243
bisphosphoglycerol-ME387728102018-764660299
cis-gondoic acidcis-Gondoic acidME3877275282768C16526847372367
citric acidCitric acidME387726311C00158617342273
creatineCreatineME387725586C00300502071115
creatinineCreatinineME387724588C00791507768115
cytosinCytosineME387723597C00380486724254
dehydroascorbic acidL-Dehydroascorbic acidME387722440667C05422633423173
docosahexaenoic acidDocosahexaenoic acidME387721445580C0642990281991
dodecanolDodecanolME3877208193C02277507619243
epsilon-caprolactamEpsilon-caprolactamME3877197768C06593353069170
erythritolErythritolME387718222285C00503471922217
erythronic acid lactoneErythrono-1,4-lactoneME3877175325915C02341407495247
ethanolamineEthanolamineME387715700C00189344719174
ethanol phosphateEthylphosphateME38771674190-317291211
fructoseFructoseME387714439709C02336639442307
fructose-6-phosphateFructose 6-phosphateME387713440641C05345804279315
fucoseFucoseME387712439650C02095578299160
fumaric acidFumaric acidME387711444972C00122390016245
gluconic acidGluconic acidME3877106857417C00800693148333
glucoseGlucoseME38770964689C00221659798319
glucose-1-phosphateGlucose 1-phosphateME38770865533C00103594647217
glucose-6-phosphateGlucose 6-phosphateME387707439427C01172810287387
glutamic acidGlutamic acidME38770633032C00025529100246
glutamineGlutamineME3877055961C00064600315156
glyceric acidGlyceric acidME387704439194C00258377495189
glycerolGlycerolME387703753C00116344466205
glycerol-alpha-phosphatesn-Glycero-3-phosphateME387702754C03189593299357
glycineGlycineME387701750C00037368707248
guanineGuanineME387700764C00242744307352
guanosineGuanosineME3876996802C00387954962324
heptadecanoic acidMargaric acidME38769810465-751309117
hippuric acidHippuric acidME387697464C01586636836206
hypoxanthineHypoxanthineME387696790C00262619128265
indole-3-lactateIndolelactic acidME38769592904C02043764586202
inosineInosineME3876946021C00294897434230
inositol-4-monophosphateInositol 4-phosphateME387693440043C03546845976315
isohexonic acid-ME387692604-698302333
isoleucineIsoleucineME3876916306C00407359251158
lactic acidLactic acidME387690612C01432217657191
lactuloseLactuloseME38768911333C07064929908204
leucineLeucineME3876886106C00123345845158
linoleic acidLinoleic acidME3876875280450C01595777414150
lysineLysineME3876865962C00047662197174
lyxitolL-ArabitolME387685439255C00532573587217
maleimideMaleimideME38768410935C07272245118154
malic acidMalic acidME387683525C00711463180233
maltoseMaltoseME387682439186C00208946601204
mannoseMannoseME38768118950C00159645856205
methanolphosphateMethanolphosphateME38768013130-289520241
methionineMethionineME3876796137C00073483560176
methionine sulfoxideMethionine sulfoxideME387678158980C02989637588128
methyl O-D-galactopyranosideMethyl beta-D-galactosideME38767794214C03619630836204
myo-inositolMyo-inositolME387676892C00137730022305
myristic acidMyristic acidME38767511005C06424634414285
n-acetyl-d-hexosamineN-AcetylhexosamineME38767424139C03878746341319
nicotinamideNiacinamideME387673936C00153469827179
oleic acidOleic acidME387672445639C00712781527339
ornithineOrnithineME3876716262C00077594878174
oxoprolineOxoprolineME3876707405C01879485935156
palmitic acidPalmitic acidME387669985C00249713809313
palmitoleic acidPalmitoleic acidME387668445638C08362704511311
panosePanoseME38766794448-1187262204
parabanic acidParabanic acidME38766667126C00802464991100
pentadecanoic acidPentadecylic acidME38766513849C16537674647117
phenylalaninePhenylalanineME3876646140C00079537804218
phosphatePhosphoric acidME3876631004C00009345365314
phosphoethanolaminePhosphoethanolamineME3876621015C00346604335299
prolineProlineME387661145742C00148364523142
pseudo uridinePseudouridineME38766015047C02067813899217
pyrophosphatePyrophosphateME3876591023C00013327517110
pyruvic acidPyruvic acidME3876581060C00022211003174
raffinoseRaffinoseME387657439242C004921120886361
ribitolRibitolME387656827C00474575497217
ribonic acidRibonic acidME3876555460677C01685597646292
riboseRiboseME3876545779C00121553135217
saccharic acidGlucaric acidME38765333037C00818699211333
serineSerineME3876525951C00065395020218
serotoninSerotoninME3876515202C00780863824174
shikimic acidShikimic acidME3876508742C00493611100204
sophoroseSophoroseME387649441432C08250962064307
sorbitolSorbitolME3876485780C00794667922217
squaleneSqualeneME387647638072C0075197623795
succinic acidSuccinic acidME3876461110C00042370608247
sucroseSucroseME3876455988C00089915139271
taurineTaurineME3876441123C00245556690326
threonic acidThreonic acidME3876435460407C01620497572292
threonineThreonineME3876426288C00188409568218
thymineThymineME3876411135C00178420133255
tyrosineTyrosineME3876406057C00082671252218
UDP-glucuronic acidUDP-glucuronic acidME38763917473C00167585473217
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME387638445675C00043625003226
uracilUracilME3876371174C00106385735241
ureaUreaME3876361176C00086328888189
uric acidUric acidME3876351175C00366730691441
uridineUridineME3876346029C00299861508217
valineValineME3876336287C00183313502144
xanthineXanthineME3876321188C00385701688353
xanthosineXanthosineME38763164959C01762926133325
xylitolXylitolME3876306912C00379567437217
xyloseXyloseME387629135191C00181546699307


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