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Details of Octopamine (4TMS)

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Role Analyte
nameOctopamine (4TMS)
MPIMP IDA203001
isotopomerambient
formulaC20H43NO2Si4
molecular mass441.903
monoisotopic mass441.23709
InChIInChI=1S/C20H43NO2Si4/c1-24(2,3)21(25(4,5)6)17-20(23-27(10,11)12)18-13-15-19(16-14-18)22-26(7,8)9/h13-16,20H,17H2,1-12H3
InChIKeyGWLMYDPVZPWGGN-UHFFFAOYSA-N
substructure TMS 
substructure TBS0
substructure H3ON 
substructure CH3O 
retention index (VAR5 method, n-alkanes C10–C36)2,024.13
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27a1449440-5579-4bbc-ac5a-76a10657fcb2%27)

Synonyms of Octopamine (4TMS)

propertyvalue
ChemSpider ID521477
PubChem CID599837
2 synonym(s)

Metabolite mapped to Octopamine (4TMS)

metabolitestereoisomerisotopomer
Octopamine  ambient
1 metabolite(s)

Reference spectra of Octopamine (4TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
25/1/2001 12:00:00 AM M[EIGTMS]Solanum tuberosum
37/19/2007 11:16:30 AM MDN35Reference Substance
49/1/2001 12:00:00 AM M[2]Standard Addition
57/19/2007 11:16:30 AM VAR5Reference Substance
67/19/2007 11:16:30 AM MDN35Reference Substance
6 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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