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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 87gd2DpwGS0
Name cis-4,11,11-trimethyl-8-methylene-bicyclo(7.2.0)undeca-4-ene
Comments MONAID: JP002819
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 C\C1=C\CCC(C2C(CC1)C(C)(C)C2)=C
SPLASH splash10-0536-8900000000-b037b8e40dd5c28531e8
Source of Spectrum SRH-2022-2819-0
Wiley ID 1825162