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Details of 3-(2,4-Dihydroxyphenyl)-propanoic acid (3TMS)

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Role Analyte
name3-(2,4-Dihydroxyphenyl)-propanoic acid (3TMS)
MPIMP IDA194018
isotopomerambient
formulaC18H34O4Si3
molecular mass398.717
monoisotopic mass398.17649
InChIInChI=1S/C18H34O4Si3/c1-23(2,3)20-16-12-10-15(17(14-16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10,12,14H,11,13H2,1-9H3
InChIKeyYTLWBALMEUUTSQ-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,949.45
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27d069c951-94f0-41ed-a40c-f33f917daeca%27)

Synonyms of 3-(2,4-Dihydroxyphenyl)-propanoic acid (3TMS)

Metabolite mapped to 3-(2,4-Dihydroxyphenyl)-propanoic acid (3TMS)

Reference spectra of 3-(2,4-Dihydroxyphenyl)-propanoic 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 8/9/2011 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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