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Details of Butanoic acid, 2-hydroxy- (2TMS)

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Role Analyte
nameButanoic acid, 2-hydroxy- (2TMS)
MPIMP IDA111002
isotopomerambient
formulaC10H24O3Si2
molecular mass248.467
monoisotopic mass248.12640
InChIInChI=1S/C10H24O3Si2/c1-8-9(12-14(2,3)4)10(11)13-15(5,6)7/h9H,8H2,1-7H3
InChIKeyNSEFDIGCPFOEIV-UHFFFAOYSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,111.63
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27d79fb63a-e3de-4e19-8fd5-9e4c5a956a61%27)

Synonyms of Butanoic acid, 2-hydroxy- (2TMS)

propertyvalue
ChemSpider ID454969
Experiment [JKopka]HTR_Glucose
synonymB000186
synonymButanoic acid, 2-hydroxy- (2TMS)
4 synonym(s)

Metabolite mapped to Butanoic acid, 2-hydroxy- (2TMS)

Reference spectra of Butanoic acid, 2-hydroxy- (2TMS)

replicaentry datedetectionmethodspecies
78/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
53/30/2011 4:52:37 PM Fiehn_GC_2010 
312/10/2010 9:09:31 AM VAR5 
68/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
411/3/2010 4:21:20 PM Schomburg_GC_2010 
17/19/2007 11:16:30 AM MDN35Reference Substance
27/19/2007 11:16:30 AM VAR5Reference Substance
86/5/2013 12:39:00 PM MRI_2013 
8 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 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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