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Details of Butanoic acid, 2-oxo- (1MEOX) (1TMS) BP

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Role Analyte
nameButanoic acid, 2-oxo- (1MEOX) (1TMS) BP
MPIMP IDA116002
isotopomerambient
formulaC8H17NO3Si
molecular mass203.311
monoisotopic mass203.09777
InChIInChI=1S/C8H17NO3Si/c1-6-7(9-11-2)8(10)12-13(3,4)5/h6H2,1-5H3/b9-7-
InChIKeyMZVDWEVOVDFJCG-CLFYSBASSA-N
substructure TMS1
substructure TBS0
substructure H3ON1
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,058.8
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%277f6ccc59-7d5c-4051-a62e-4b012c742ebb%27)

Synonyms of Butanoic acid, 2-oxo- (1MEOX) (1TMS) BP

Metabolite mapped to Butanoic acid, 2-oxo- (1MEOX) (1TMS) BP

Reference spectra of Butanoic acid, 2-oxo- (1MEOX) (1TMS) BP

replicaentry datedetectionmethodspecies
53/30/2011 4:52:37 PM Fiehn_GC_2010 
411/3/2010 4:21:20 PM Schomburg_GC_2010 
111/26/2004 12:00:00 AM M[FAME4090]Standard
25/12/2005 12:00:00 AM M[NIST] 
37/19/2007 11:16:30 AM VAR5Reference Substance
5 spectrum(a)
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/9/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
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