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Cyclohexanone, 4-acetyl-
SpectraBase Compound ID BnZozqAoqC6
InChI InChI=1S/C8H12O2/c1-6(9)7-2-4-8(10)5-3-7/h7H,2-5H2,1H3
InChIKey LGJYVZNKQBEZGD-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ggJ1p8aXte
Name Cyclohexanone, 4-acetyl-
Alternate Name(s) 4-Acetylcyclohexanone 4-Acetyl-1-cyclohexanone 4-Acetylcyclohexan-1-one 4-Ethanoylcyclohexan-1-one
CAS Registry Number 5034-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-6(9)7-2-4-8(10)5-3-7/h7H,2-5H2,1H3
InChIKey LGJYVZNKQBEZGD-UHFFFAOYSA-N
Molecular Weight 140.182 g/mol
SMILES C1(C(C)=O)CCC(=O)CC1
SPLASH splash10-0006-9100000000-00a11f72b902fb90adce
Source of Spectrum AD-0-2532-0
Wiley ID 1422840