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2-Cyclohexen-1-one, 4-(1-methylethyl)-2-(5-methyl-4-hexenyl)-, (.+-.)-
SpectraBase Compound ID 4QG3ALqO8YD
InChI InChI=1S/C16H26O/c1-12(2)7-5-6-8-15-11-14(13(3)4)9-10-16(15)17/h7,11,13-14H,5-6,8-10H2,1-4H3
InChIKey BZONNORVBZMDCK-UHFFFAOYSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH3TMWen5rI
Name 2-Cyclohexen-1-one, 4-(1-methylethyl)-2-(5-methyl-4-hexenyl)-, (.+-.)-
Alternate Name(s) 4-isopropyl-2-(5-methyl-4-hexenyl)-2-cyclohexen-1-one 4-Isopropyl-2-(5-methyl-4-hexenyl)-cyclohex-2-en-1-one rac-(1R,5R,6S,7R)-7-isopropenyl-5-isopropyl-bicyclo[4.4.0]decan-2-one
CAS Registry Number 94853-10-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O
InChI InChI=1S/C16H26O/c1-12(2)7-5-6-8-15-11-14(13(3)4)9-10-16(15)17/h7,11,13-14H,5-6,8-10H2,1-4H3
InChIKey BZONNORVBZMDCK-UHFFFAOYSA-N
Molecular Weight 234.383 g/mol
SMILES C1=C(C(=O)CCC1C(C)C)CCCC=C(C)C
SPLASH splash10-001i-1190000000-a8ebc3ccd2fcd67e4201
Source of Spectrum F-40-3497-0
Wiley ID 1236629