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2-Cyclohexen-1-one, 3-butyl-2-methyl-5-(1-methylethenyl)-
SpectraBase Compound ID IyCoz8629C1
InChI InChI=1S/C14H22O/c1-5-6-7-12-8-13(10(2)3)9-14(15)11(12)4/h13H,2,5-9H2,1,3-4H3
InChIKey FLWIQIJAYWRIJR-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KntX3xFms1k
Name 2-Cyclohexen-1-one, 3-butyl-2-methyl-5-(1-methylethenyl)-
Alternate Name(s) 3-Butyl-5-isopropenyl-2-methyl-2-cyclohexen-1-one 3-n-butyl-5-isopropenyl-2-methyl-2-cyclo-hexen-1-one
CAS Registry Number 56561-27-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-5-6-7-12-8-13(10(2)3)9-14(15)11(12)4/h13H,2,5-9H2,1,3-4H3
InChIKey FLWIQIJAYWRIJR-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
SMILES C1(=C(CC(CC1=O)C(=C)C)CCCC)C
SPLASH splash10-0a4m-9710000000-5c72a18539c2cc331800
Source of Spectrum C-97-4023-0
Wiley ID 1204999