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4,6-Diacetyl-3-hydroxy-3-methylcyclohexanone
SpectraBase Compound ID JjnLNkVIoky
InChI InChI=1S/C11H16O4/c1-6(12)8-4-9(7(2)13)11(3,15)5-10(8)14/h8-9,15H,4-5H2,1-3H3
InChIKey LDTXKLFJGAOGQT-UHFFFAOYSA-N
Mol Weight 212.24 g/mol
Molecular Formula C11H16O4
Exact Mass 212.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFpKLMJdiao
Name 4,6-Diacetyl-3-hydroxy-3-methylcyclohexanone
Alternate Name(s) 1,1'-(4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O4
InChI InChI=1S/C11H16O4/c1-6(12)8-4-9(7(2)13)11(3,15)5-10(8)14/h8-9,15H,4-5H2,1-3H3
InChIKey LDTXKLFJGAOGQT-UHFFFAOYSA-N
Molecular Weight 212.245 g/mol
SMILES OC1(CC(C(CC1C(=O)C)C(=O)C)=O)C
SPLASH splash10-0a4i-9600000000-d82324c7cff55539e557
Source of Spectrum JX-2015-6-2719
Wiley ID 1728373