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14-hydroxy-4,5-dihydro-.beta.-Caryophyllene
SpectraBase Compound ID 5su0rnmMsG5
InChI InChI=1S/C15H26O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h12-14,16H,1,4-10H2,2-3H3/t12-,13+,14+/m0/s1
InChIKey QPKKKWDNDWSIRV-BFHYXJOUSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2ob9qhrHa1
Name 14-Hydroxy-4,5-dihydro-caryophyllene
CAS Registry Number 289621-83-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O
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/C15H26O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h12-14,16H,1,4-10H2,2-3H3/t12-,13+,14+/m0/s1
InChIKey QPKKKWDNDWSIRV-BFHYXJOUSA-N
Molecular Weight 222.372 g/mol
SMILES OC[C@]1(CCCC([C@@]2([C@@](CC1)(C(C2)(C)C)[H])[H])=C)[H]
SPLASH splash10-00kf-9300000000-42270eac17768c8d7ed4
Source ex BETUAL PENDULA
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Caryophyllene<14-hydroxy-4,5-dihydro->
Wiley ID 1886042