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Cyclohexanone, 2-acetyl-3,3-dimethyl-
SpectraBase Compound ID KDot75BzrXz
InChI InChI=1S/C10H16O2/c1-7(11)9-8(12)5-4-6-10(9,2)3/h9H,4-6H2,1-3H3
InChIKey SAXRDSONVLHHOZ-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiGxRxGCgp1
Name Cyclohexanone, 2-acetyl-3,3-dimethyl-
CAS Registry Number 54200-63-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-7(11)9-8(12)5-4-6-10(9,2)3/h9H,4-6H2,1-3H3
InChIKey SAXRDSONVLHHOZ-UHFFFAOYSA-N
Molecular Weight 168.236 g/mol
SMILES C1(C(CCCC1=O)(C)C)C(=O)C
SPLASH splash10-01ox-9700000000-23677aa8f6334826c15c
Source of Spectrum H-57-1323-4
Synonyms 2-Acetyl-3,3-dimethylcyclohexanone 3,3-Dimethyl-2-acetyl-1-cyclohexanone 3,3-Dimethyl-2-acetylcyclohexanone 2-Acetyl-3,3-dimethyl-1-cyclohexanone 2-Acetyl-3,3-dimethylcyclohexan-1-one 2-Ethanoyl-3,3-dimethyl-cyclohexan-1-one
Wiley ID 1164625