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Details of Geraniol (1TMS)

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Role Analyte
nameGeraniol (1TMS)
MPIMP IDA136007
isotopomerambient
formulaC13H26OSi
molecular mass226.431
monoisotopic mass226.17529
InChIInChI=1S/C13H26OSi/c1-12(2)8-7-9-13(3)10-11-14-15(4,5)6/h8,10H,7,9,11H2,1-6H3/b13-10+
InChIKeyWJOVQJSWBJCMJE-JLHYYAGUSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,361.11
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2790e352f2-37a3-47fd-93a5-830af209c85c%27)

Synonyms of Geraniol (1TMS)

propertyvalue
ChemSpider ID9173917
PubChem CID10998725
synonymB000403
synonymGeraniol (1TMS)
4 synonym(s)

Metabolite mapped to Geraniol (1TMS)

metabolitestereoisomerisotopomer
Geraniol  ambient
1 metabolite(s)

Reference spectra of Geraniol (1TMS)

replicaentry datedetectionmethodspecies
27/19/2007 11:16:30 AM VAR5Reference Substance
33/30/2011 4:52:37 PM Fiehn_GC_2010 
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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