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3-Cyclohexen-1-one, 4-[[4-(1-methylethenyl)-1-cyclohexen-1-yl]methyl]-, (S)-
SpectraBase Compound ID 5CXRtxqniUS
InChI InChI=1S/C16H22O/c1-12(2)15-7-3-13(4-8-15)11-14-5-9-16(17)10-6-14/h3,5,15H,1,4,6-11H2,2H3/t15-/m1/s1
InChIKey WYCIGEYZHHNXNV-OAHLLOKOSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7EicievLBee
Name 3-Cyclohexen-1-one, 4-[[4-(1-methylethenyl)-1-cyclohexen-1-yl]methyl]-, (S)-
CAS Registry Number 129194-19-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-12(2)15-7-3-13(4-8-15)11-14-5-9-16(17)10-6-14/h3,5,15H,1,4,6-11H2,2H3/t15-/m1/s1
InChIKey WYCIGEYZHHNXNV-OAHLLOKOSA-N
Molecular Weight 230.351 g/mol
SMILES C([C@@]1(CC=C(CC1)CC1=CCC(CC1)=O)[H])(=C)C
SPLASH splash10-054o-8900000000-697b7e55a71a66ec2208
Source of Spectrum C-112-7302-6
Synonyms (S)-4-[[4-(1-methylethenyl)-1-cyclohexen-1-yl]ethyl]-3-cyclohexen-1-one 4-{[(4S)-4-isopropenyl-1-cyclohexen-1-yl]methyl}-3-cyclohexen-1-one
Wiley ID 1232330