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2-Cyclohexen-1-one, 6-ethyl-2,6-dimethyl-5-(1-methylethenyl)-, (5S-cis)-
SpectraBase Compound ID AvBXdlc9elP
InChI InChI=1S/C13H20O/c1-6-13(5)11(9(2)3)8-7-10(4)12(13)14/h7,11H,2,6,8H2,1,3-5H3/t11-,13+/m0/s1
InChIKey BOKOLZLBONUNLM-WCQYABFASA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CrmgDaqphvW
Name 2-Cyclohexen-1-one, 6-ethyl-2,6-dimethyl-5-(1-methylethenyl)-, (5S-cis)-
CAS Registry Number 126784-62-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-6-13(5)11(9(2)3)8-7-10(4)12(13)14/h7,11H,2,6,8H2,1,3-5H3/t11-,13+/m0/s1
InChIKey BOKOLZLBONUNLM-WCQYABFASA-N
Molecular Weight 192.302 g/mol
SMILES [C@]1(C(C(C)=CC[C@]1(C(=C)C)[H])=O)(CC)C
SPLASH splash10-01pp-9400000000-ab03bf611f730511335d
Source of Spectrum F-45-5860-3
Synonyms (4S,5S)-4.alpha.-ethyl-2,4.beta.-dimethyl-5-propen-2-yl-cyclohexen-3-one (5S,6R)-6-ethyl-5-isopropenyl-2,6-dimethyl-2-cyclohexen-1-one (5S,6S)-6-ethyl-6-methyl carvone
Wiley ID 1188975