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Details of Phosphonoacetic acid (3TMS)

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Role Analyte
namePhosphonoacetic acid (3TMS)
MPIMP IDA152009
isotopomerambient
formulaC11H29O5PSi3
molecular mass356.575
monoisotopic mass356.10604
InChIInChI=1S/C11H29O5PSi3/c1-18(2,3)14-11(12)10-17(13,15-19(4,5)6)16-20(7,8)9/h10H2,1-9H3
InChIKeyBHJOIVXJMQHKIY-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,522.99
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%273062a25d-641b-4edc-9b54-dfe65c4d89ee%27)

Synonyms of Phosphonoacetic acid (3TMS)

propertyvalue
ChemSpider ID547957
PubChem CID631032
synonymB000833
synonymPhosphonoacetic acid (3TMS)
4 synonym(s)

Metabolite mapped to Phosphonoacetic acid (3TMS)

Reference spectra of Phosphonoacetic acid (3TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
27/19/2007 11:16:30 AM MDN35Reference Substance
2 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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