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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 2meEmCWDVA
Name .beta.-Caryophyllene
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.187800773 u
Formula C15H24
GC Column HP-5 (30 m x 0.25 mm x 0.25 micrometer)
GC Oven Program Oven temp 250oC
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
Inlet Type Split (20:1)
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202200566
Molecular Weight 204.357 g/mol
Quality 274
SMILES C\C1=C/CCC(=C)[C@]2(CC([C@@]2(CC1)[H])(C)C)[H]
SPLASH splash10-05po-6900000000-a0aa6a437363512513f5
Source of Spectrum CBD-20-SM3-34 (DOI: 10.1002/cbdv.202200566)
Wiley ID 1901399