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Analysis: GCMS positive ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
AcetoacetateAcetoacetic acidME69711996C00164--
AcetateAcetic acidME697118176C00033--
AcetoneAcetoneME697120180C00207--
Beta- alaninebeta-AlanineME697126239C00099--
Benzoic acidBenzoic acidME697125243C00180--
CitrateCitric acidME697128311C00158--
CreatineCreatineME697129586C00300--
CreatinineCreatinineME697130588C00791--
CysteineCysteineME697132594C00097--
GlycineGlycineME697145750C00037--
GlycerolGlycerolME697143753C00116--
Glycolic acidGlycolic acidME697146757C00160--
ArabitolArabitolME697124827C01904--
MalonateMalonic acidME697156867C00383--
Nicotinic acidNicotinic acidME697162938C00253--
Oxalic acidOxalic acidME697168971C00209--
Palmitic acidPalmitic acidME697169985C00249--
Phosphoric acidPhosphoric acidME6971721004C00009--
Pyruvic acidPyruvic acidME6971761060C00022--
TagatoseD-TagatoseME6971821101---
SuccinateSuccinic acidME6971801110C00042--
Uric acidUric acidME6971881175C00366--
UreaUreaME6971871176C00086--
SerotoninSerotoninME6971785202C00780--
Stearic acidStearic acidME6971795281C01530--
Glucose_AGlucoseME6971375793C00031--
Glucose_betaGlucoseME6971385793C00031--
AlanineAlanineME6971225950C00041--
SerineSerineME6971775951C00065--
GlutamineGlutamineME6971415961C00064--
LysineLysineME6971545962C00047--
SucroseSucroseME6971815988C00089--
CholesterolCholesterolME6971275997C00187--
TyrosineTyrosineME6971866057C00082--
LeucineLeucineME6971526106C00123--
PhenylalaninePhenylalanineME6971716140C00079--
MannitolMannitolME6971576251C00392--
OrnithineOrnithineME6971676262C00077--
ValineValineME6971896287C00183--
ThreonineThreonineME6971846288C00188--
TryptophanTryptophanME6971856305C00078--
IsoleucineIsoleucineME6971496306C00407--
2-hydroxypyridine2-HydroxypyridineME6971158871C02502--
MethylguanidineMethylguanidineME69716010111C02294--
Heptadecanoic acidMargaric acidME69714710465---
Gluconic acidGluconic acidME69713610690C00257--
Myristic acidMyristic acidME69716111005C06424--
NorleucineNorleucineME69716421236C01933--
Glutamic acidGlutamic acidME69713933032---
Galacturonic acidGalacturonic acidME69713584740C08348--
MelezitoseMelezitoseME69715892817C08243--
LactateLactic acidME697151107689C00186--
ProlineProlineME697174145742C00148--
ThreitolThreitolME697183169019C16884--
Malic acidMalic acidME697155222656C00149--
Glyceric acidGlyceric acidME697142439194C00258--
NorvalineNorvalineME697165439575C01799--
Fumaric acidFumaric acidME697133444972C00122--
Palmitoleic acidPalmitoleic acidME697170445638C08362--
Oleic acidOleic acidME697166445639C00712--
PyrophosphatePyrophosphateME697175644102C00013--
Linoleic acidLinoleic acidME6971535280450C01595--
PorphinePorphyrin-ringME6971735481287---
GalactinolGalactinolME69713411727586C01235--
2-HB (2-hydroxybutyric acid)-ME697114----
3-AIB (a-amino[1-(14)C]isobutyric acid)-ME697116----
3-HB (3-hydroxybutyric acid)-ME697117----
Acetylsalicylic acidAspirinME697121----
Allo-inositol-ME697123----
Creatinine g-ME697131----
Glutamic acid (dehydrated)-ME697140----
Glycerol -1-Psn-Glycero-3-phosphateME697144----
Iminodiacetic acidIminodiacetateME697148----
Isopropyl beta--thiogalactopyranoside-ME697150----
MethylamineMethylamineME697159----
N-methylhistidineN-MethylhistidineME697163-C03298--


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