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Caryophyllene oxide
SpectraBase Compound ID LxfF72Y9Fx9
InChI InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+,15-/m1/s1
InChIKey NVEQFIOZRFFVFW-GUIRCDHDSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 930Dnev0PQ
Name Caryophyllene-alpha-oxide
Alternate Name(s) (1R,4R,6S,10S)-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0(4,6)]dodecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+,15-/m1/s1
InChIKey NVEQFIOZRFFVFW-GUIRCDHDSA-N
Literature Reference DOI 10.1002/jccs.200300022
Molecular Weight 220.356 g/mol
SMILES [C@@]12([C@](O2)([H])CCC([C@@]2([C@@]([H])(CC1)C(C)(C)C2)[H])=C)C
SPLASH splash10-0ar3-9400000000-b078d0e4af25fe698f27
Source of Spectrum QA-50-164-9
Wiley ID 1795720