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Details of Malonic acid, methyl- (2TMS)

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Role Analyte
nameMalonic acid, methyl- (2TMS)
MPIMP IDA122004
isotopomerambient
formulaC10H22O4Si2
molecular mass262.451
monoisotopic mass262.10566
InChIInChI=1S/C10H22O4Si2/c1-8(9(11)13-15(2,3)4)10(12)14-16(5,6)7/h8H,1-7H3
InChIKeyLJDAAXOEMCESSS-UHFFFAOYSA-N
substructure TMS 
substructure TBS0
substructure H3ON 
substructure CH3O 
retention index (VAR5 method, n-alkanes C10–C36)1,207.61
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2768b7ca61-577a-4994-8804-8ba194e88278%27)

Synonyms of Malonic acid, methyl- (2TMS)

Metabolite mapped to Malonic acid, methyl- (2TMS)

Reference spectra of Malonic acid, methyl- (2TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM MDN35Reference Substance
28/1/2002 12:00:00 AM M[2]Lotus japonicus (Regel) K. Larsen
37/19/2007 11:16:30 AM VAR5Reference Substance
106/5/2013 12:39:00 PM MRI_2013 
73/30/2011 4:52:37 PM Fiehn_GC_2010 
88/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
98/28/2012 5:51:49 PM MassBank GC 2010 Ara 
48/1/2002 12:00:00 AM M[2]Lotus japonicus (Regel) K. Larsen
510/4/2010 4:55:13 PM VAR5Reference Substance
610/4/2010 4:58:44 PM VAR5Reference Substance
10 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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