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8-.alpha.-11-Elemodiol
SpectraBase Compound ID L74V9ctiwV4
InChI InChI=1S/C15H26O2/c1-7-15(6)9-13(16)12(14(4,5)17)8-11(15)10(2)3/h7,11-13,16-17H,1-2,8-9H2,3-6H3/t11-,12-,13-,15+/m1/s1
InChIKey PREYUFUUILQIMJ-BHPKHCPMSA-N
Mol Weight 238.37 g/mol
Molecular Formula C15H26O2
Exact Mass 238.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQwSfxdjoBW
Name 8-.alpha.-11-Elemodiol
CAS Registry Number 64373-81-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O2
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/C15H26O2/c1-7-15(6)9-13(16)12(14(4,5)17)8-11(15)10(2)3/h7,11-13,16-17H,1-2,8-9H2,3-6H3/t11-,12-,13-,15+/m1/s1
InChIKey PREYUFUUILQIMJ-BHPKHCPMSA-N
Molecular Weight 238.371 g/mol
SMILES O[C@@]1(C[C@]([C@](C[C@]1(C(C)(C)O)[H])(C(=C)C)[H])(C)C=C)[H]
SPLASH splash10-052f-9300000000-214520dac734c37b5693
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Elemodiol<8-.alpha.-11->
Wiley ID 1886280