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Details of Pyrophosphate (4TMS)

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Role Analyte
namePyrophosphate (4TMS)
MPIMP IDA168004
isotopomerambient
formulaC12H36O7P2Si4
molecular mass466.700
monoisotopic mass466.10133
InChIInChI=1S/C12H36O7P2Si4/c1-22(2,3)16-20(13,17-23(4,5)6)15-21(14,18-24(7,8)9)19-25(10,11)12/h1-12H3
InChIKeyJDZAIGYGOBAGGF-UHFFFAOYSA-N
substructure TMS4
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,653.35
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27502d3249-34cf-4eba-b1b1-dd77ac9bd183%27)

Synonyms of Pyrophosphate (4TMS)

Metabolite mapped to Pyrophosphate (4TMS)

Reference spectra of Pyrophosphate (4TMS)

replicaentry datedetectionmethodspecies
25/12/2005 12:00:00 AM M[NIST] 
1211/3/2010 4:23:02 PM Schomburg_GC_2010 
133/30/2011 4:52:37 PM Fiehn_GC_2010 
511/1/2001 12:00:00 AM M[EIGTMS]Corynebacterium glutamicum
69/1/2001 12:00:00 AM M[EIGTMS]Saccharomyces cerevisiae
72/22/2005 12:00:00 AM M[STR] 
85/12/2005 12:00:00 AM M[NIST] 
112/22/2005 12:00:00 AM M[STR] 
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 8/11/2011 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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