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Dimethyl-6-acetyl-2-oxocyclohex-3-ene-1,1-dicarboxylate
SpectraBase Compound ID K0Sumb4QV77
InChI InChI=1S/C12H14O6/c1-7(13)8-5-4-6-9(14)12(8,10(15)17-2)11(16)18-3/h4,6,8H,5H2,1-3H3
InChIKey BOFMPDOSZIXOLO-UHFFFAOYSA-N
Mol Weight 254.24 g/mol
Molecular Formula C12H14O6
Exact Mass 254.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dBwgRgVBEj
Name 3-Cyclohexene-1,1-dicarboxylic acid, 6-acetyl-2-oxo-, dimethyl ester
CAS Registry Number 119582-50-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O6
InChI InChI=1S/C12H14O6/c1-7(13)8-5-4-6-9(14)12(8,10(15)17-2)11(16)18-3/h4,6,8H,5H2,1-3H3
InChIKey BOFMPDOSZIXOLO-UHFFFAOYSA-N
Molecular Weight 254.238 g/mol
SMILES C1(C(=O)OC)(C(=O)OC)C(C(=O)C)CC=CC1=O
SPLASH splash10-066u-9300000000-91d3bc52acbaf8eb01e4
Source of Spectrum B-40-1839-15
Synonyms Dimethyl 6-acetyl-2-oxo-3-cyclohexene-1,1-dicarboxylate Dimethyl 6-acetyl-2-oxocyclohex-3-ene-1,1-dicarboxylate
Wiley ID 1257380