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Details of Muconic acid, trans,trans- (2TMS)

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Role Analyte
nameMuconic acid, trans,trans- (2TMS)
MPIMP IDA162003
isotopomerambient
formulaC12H22O4Si2
molecular mass286.472
monoisotopic mass286.10566
InChIInChI=1S/C12H22O4Si2/c1-17(2,3)15-11(13)9-7-8-10-12(14)16-18(4,5)6/h7-10H,1-6H3/b9-7+,10-8+
InChIKeyKHJKWFOTLGKLGS-FIFLTTCUSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,625.79
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2773a56d11-0cbf-427d-b818-0661b80d8d02%27)

Synonyms of Muconic acid, trans,trans- (2TMS)

propertyvalue
ChemSpider ID4518399
PubChem CID5366613
synonymB000731
synonymMuconic acid, trans,trans- (2TMS)
4 synonym(s)

Metabolite mapped to Muconic acid, trans,trans- (2TMS)

Reference spectra of Muconic acid, trans,trans- (2TMS)

replicaentry datedetectionmethodspecies
33/30/2011 4:52:37 PM Fiehn_GC_2010 
17/19/2007 11:16:30 AM VAR5Reference Substance
27/19/2007 11:16:30 AM MDN35Reference Substance
3 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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