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Isocaryophyllene
SpectraBase Compound ID E1C88xlnDsp
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-
InChIKey NPNUFJAVOOONJE-WDZFZDKYSA-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 FdKJuL8wMrV
Name .beta.-Caryophyllene
Comments MONAID: JP010683
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24
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-
InChIKey NPNUFJAVOOONJE-WDZFZDKYSA-N
Ionization Type EI-B
Molecular Weight 204.357 g/mol
SMILES C1\C=C/(CCC2C(C(C1)=C)CC2(C)C)C
SPLASH splash10-0006-9400000000-e83481e89f4d8818a733
Source of Spectrum SRH-2022-10683-0
Wiley ID 1832295