GOLM METABOLOME DATABASE

Details of [643798] citraconic acid 3 [12.222]

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Role Analyte
name[643798] citraconic acid 3 [12.222]
MPIMP IDA143022
isotopomerambient
formula 
molecular mass 
monoisotopic mass 
InChI
InChIKey
substructure TMS 
substructure TBS 
substructure H3ON 
substructure CH3O 
retention index (VAR5 method, n-alkanes C10–C36)1,432.18
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27e5b7cff8-cc5c-433e-be2e-eb3c821f85ea%27)

Synonyms of [643798] citraconic acid 3 [12.222]

Metabolite mapped to [643798] citraconic acid 3 [12.222]

Reference spectra of [643798] citraconic acid 3 [12.222]

replicaentry datedetectionmethodspecies
13/30/2011 4:52:37 PM Fiehn_GC_2010 
1 spectrum(a)
compound timestamp information
deposited at 3/28/2011 by Kopka J., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), 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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