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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 9ywEcPBhFI3
Name Farnesene <(E,E)-, alpha->
Source of Sample SAFC Cat.no. W212202
CAS Registry Number 502-61-4
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. 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
Molecular Weight 204.357 g/mol
Number of Peaks 50
RI1 1504
RI2 1181
SMILES C=C\C(=C\C\C=C\(CCC=C(C)C)C)C
SPLASH splash10-0006-9300000000-bf5738669022dc6c4cc9
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,3,6,10-Dodecatetraene, 3,7,11-trimethyl-, (3E,6E)-
Wiley ID LM_FFNSC3_1073