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3-Acetyl-5-keto-cyclohexane-1,2-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 5dC1dJeI4jP
InChI InChI=1S/C12H16O6/c1-6(13)8-4-7(14)5-9(11(15)17-2)10(8)12(16)18-3/h8-10H,4-5H2,1-3H3
InChIKey MSVGOKBHWMBMFN-UHFFFAOYSA-N
Mol Weight 256.25 g/mol
Molecular Formula C12H16O6
Exact Mass 256.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Dp5UH1Ra32
Name 3-Acetyl-5-keto-cyclohexane-1,2-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O6
InChI InChI=1S/C12H16O6/c1-6(13)8-4-7(14)5-9(11(15)17-2)10(8)12(16)18-3/h8-10H,4-5H2,1-3H3
InChIKey MSVGOKBHWMBMFN-UHFFFAOYSA-N
Molecular Weight 256.254 g/mol
SMILES C1(C(C(C(=O)C)CC(C1)=O)C(=O)OC)C(=O)OC
SPLASH splash10-0f6y-8910000000-08c416cb5f505df6e0f6
Source of Spectrum HE-1986-1529-0
Synonyms Cyclohexanone, 3-acetyl-4,5-bis(carbomethoxy)- 3-Acetyl-5-oxocyclohexane-1,2-dicarboxylic acid dimethyl ester Dimethyl 3-acetyl-5-oxo-1,2-cyclohexanedicarboxylate Dimethyl 3-acetyl-5-oxo-cyclohexane-1,2-dicarboxylate Dimethyl 3-ethanoyl-5-oxidanylidene-cyclohexane-1,2-dicarboxylate
Wiley ID 1259409