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Details of Iminodiacetic acid (3TMS)

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Role Analyte
nameIminodiacetic acid (3TMS)
MPIMP IDA151020
isotopomerambient
formulaC13H31NO4Si3
molecular mass349.646
monoisotopic mass349.15609
InChIInChI=1S/C13H31NO4Si3/c1-19(2,3)14(10-12(15)17-20(4,5)6)11-13(16)18-21(7,8)9/h10-11H2,1-9H3
InChIKeyWUDZWKFXCJLXOX-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,521.37
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2711aea542-ba84-4094-9bec-86bdfc80b833%27)

Synonyms of Iminodiacetic acid (3TMS)

propertyvalue
Experiment [JKopka]HTR_Glycine
synonymB000580
synonymIminodiacetic acid (3TMS)
3 synonym(s)

Metabolite mapped to Iminodiacetic acid (3TMS)

Reference spectra of Iminodiacetic acid (3TMS)

replicaentry datedetectionmethodspecies
32/12/2010 5:16:00 PM VAR5 
53/30/2011 4:52:37 PM Fiehn_GC_2010 
17/19/2007 11:16:30 AM MDN35Reference Substance
64/5/2011 5:53:57 PM VAR5 
43/12/2010 9:22:00 AM MDN35 
85/6/2011 1:16:34 PM VAR5 
74/6/2011 7:25:12 PM VAR5 
26/10/2009 1:20:53 PM VAR5Reference Substance
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 8/9/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Kopka J., Hummel J.
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