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Details of Isobutanoic acid, 3-amino- (3TMS)

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Role Analyte
nameIsobutanoic acid, 3-amino- (3TMS)
MPIMP IDA145012
isotopomerambient
formulaC13H33NO2Si3
molecular mass319.663
monoisotopic mass319.18191
InChIInChI=1S/C13H33NO2Si3/c1-12(13(15)16-19(8,9)10)11-14(17(2,3)4)18(5,6)7/h12H,11H2,1-10H3
InChIKeyCAYUWFAMARZETO-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,455.34
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27bacc1166-b58a-4335-9086-7ccc5cc4840f%27)

Synonyms of Isobutanoic acid, 3-amino- (3TMS)

propertyvalue
ChemSpider ID481197
PubChem CID553272
synonymB000610
synonymIsobutanoic acid, 3-amino- (3TMS)
4 synonym(s)

Metabolite mapped to Isobutanoic acid, 3-amino- (3TMS)

Reference spectra of Isobutanoic acid, 3-amino- (3TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
27/19/2007 11:16:30 AM MDN35Reference Substance
43/30/2011 4:52:37 PM Fiehn_GC_2010 
37/19/2007 11:16:30 AM VAR5Reference Substance
4 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.
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