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(6S,7R)-Bisabolone
SpectraBase Compound ID PH7hg8nwvr
InChI InChI=1S/C15H24O/c1-11(2)6-5-7-13(4)14-9-8-12(3)10-15(14)16/h6,10,13-14H,5,7-9H2,1-4H3/t13-,14+/m0/s1
InChIKey KNOUERLLBMJGLF-UONOGXRCSA-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 AtTrM6yNnmp
Name (6R)-3-methyl-6-[(2S)-6-methylhept-5-en-2-yl]-1-cyclohex-2-enone
CAS Registry Number 61432-71-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-11(2)6-5-7-13(4)14-9-8-12(3)10-15(14)16/h6,10,13-14H,5,7-9H2,1-4H3/t13-,14+/m0/s1
InChIKey KNOUERLLBMJGLF-UONOGXRCSA-N
Molecular Weight 220.356 g/mol
SMILES C1(C=C(C)CC[C@@]1([C@](CCC=C(C)C)(C)[H])[H])=O
SPLASH splash10-01p9-0910000000-fd01077e9e6d3faac9e9
Source of Spectrum K-109-3370-0
Synonyms (6R)-3-methyl-6-[(2S)-6-methylhept-5-en-2-yl]cyclohex-2-en-1-one (6R)-6-[(1S)-1,5-dimethylhex-4-enyl]-3-methyl-cyclohex-2-en-1-one 1-Bisabolone
Wiley ID 1220504