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Details of Malic acid, 2-isopropyl- (3TMS)

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Role Analyte
nameMalic acid, 2-isopropyl- (3TMS)
MPIMP IDA158003
isotopomerambient
formulaC16H36O5Si3
molecular mass392.711
monoisotopic mass392.18706
InChIInChI=1S/C16H36O5Si3/c1-13(2)16(21-24(9,10)11,15(18)20-23(6,7)8)12-14(17)19-22(3,4)5/h13H,12H2,1-11H3
InChIKeyNCWMZDPQUOFGKZ-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,570.38
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%276dbb41cd-91a7-4eae-963d-b176206e8e89%27)

Synonyms of Malic acid, 2-isopropyl- (3TMS)

Metabolite mapped to Malic acid, 2-isopropyl- (3TMS)

Reference spectra of Malic acid, 2-isopropyl- (3TMS)

replicaentry datedetectionmethodspecies
19/1/2001 12:00:00 AM M[EIGTMS]Saccharomyces cerevisiae
78/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
63/30/2011 4:52:37 PM Fiehn_GC_2010 
27/19/2007 11:16:30 AM VAR5Reference Substance
47/19/2007 11:16:30 AM MDN35Reference Substance
510/12/2005 12:00:00 AM M[BAR] 
6 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.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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