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(E)-(1R,9S)-(-)-8-methylene-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene
SpectraBase Compound ID 7bXeVOCOePw
InChI InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6+/t13-,14-/m1/s1
InChIKey NPNUFJAVOOONJE-GFUGXAQUSA-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 36vma8r9DVd
Name Caryophyllene(E-)
CAS Registry Number 87-44-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6+/t13-,14-/m1/s1
InChIKey NPNUFJAVOOONJE-GFUGXAQUSA-N
Molecular Weight 204.357 g/mol
SMILES C1(C)(C)[C@]2([C@](C1)(C(=C)CC\C=C\(CC2)C)[H])[H]
SPLASH splash10-0006-9500000000-d3487082f938659b6c38
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886040