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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 ILSaOAzzGpL
Name Farnesene<(E,E)-alpha->
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
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
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
Nominal Mass 204 u
Number of Peaks 120
SMILES C(\C(=C\C\C=C\(C=C)C)C)CC=C(C)C
SPLASH splash10-0006-9300000000-96d2923df26d2f4403b6
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001627