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Details of Itaconic acid (2TBS)

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Role	Analyte
name	Itaconic acid (2TBS)
MPIMP ID	A000033
isotopomer	ambient
formula
molecular mass
monoisotopic mass
InChI	InChI=1S/C17H34O4Si2/c1-13(15(19)21-23(10,11)17(5,6)7)12-14(18)20-22(8,9)16(2,3)4/h1,12H2,2-11H3
InChIKey	YPXRTKMWVGKUQN-UHFFFAOYSA-N
substructure TMS	0
substructure TBS	2
substructure H3ON	0
substructure CH3O	0
retention index (VAR5 method, n-alkanes C10–C36)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27b7b71aef-aca5-4c72-84a0-c6243c1e50c4%27)

Synonyms of Itaconic acid (2TBS)

property	value
ChemSpider ID	4934247
synonym	ITACONIC ACID, TBS 2X
2 synonym(s)

Metabolite mapped to Itaconic acid (2TBS)

metabolite	stereoisomer	isotopomer
Itaconic acid		ambient
1 metabolite(s)

Reference spectra of Itaconic acid (2TBS)

replica	entry date	detection	method	species
no spectra available!

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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