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.alpha.-Farnesene isomer [3,7,11-Trimethyl-1,3,6,10-dodecatetraene]
SpectraBase Compound ID OG99VlpaeX
InChI InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9-10,12H,1,7-8,11H2,2-5H3/b14-10+,15-12+
InChIKey CXENHBSYCFFKJS-VDQVFBMKSA-N
Mol Weight 204.36 g/mol
Molecular Formula C15H24
Exact Mass 204.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ks5NAchaOz
Name alpha-Farnesene
CAS Registry Number 502-61-4
Classification Sesquiterpene
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 204.187800773 u
Formula C15H24
InChI InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9-10,12H,1,7-8,11H2,2-5H3/b14-10+,15-12+
InChIKey CXENHBSYCFFKJS-VDQVFBMKSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 204.357 g/mol
Nominal Mass 204 u
Quality 984
Retention Index 1437
SMILES C(\C=C\(CCC=C(C)C)C)\C=C\(C=C)C
SPLASH splash10-0006-9300000000-a9e92265dc52c6b5bcbc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene
Technique GC/MS
Wiley ID DD2024_035094