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Cyclohexanecarboxylic acid, 1-(4-methylphenyl)-2-oxo-, methyl ester
SpectraBase Compound ID GoRhS4XKKke
InChI InChI=1S/C15H18O3/c1-11-6-8-12(9-7-11)15(14(17)18-2)10-4-3-5-13(15)16/h6-9H,3-5,10H2,1-2H3
InChIKey FTBALRBJPXNOCC-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B17zAxPCFWq
Name Cyclohexanecarboxylic acid, 1-(4-methylphenyl)-2-oxo-, methyl ester
CAS Registry Number 74851-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-11-6-8-12(9-7-11)15(14(17)18-2)10-4-3-5-13(15)16/h6-9H,3-5,10H2,1-2H3
InChIKey FTBALRBJPXNOCC-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES C1(C(=O)OC)(C(=O)CCCC1)c1ccc(cc1)C
SPLASH splash10-05mn-1940000000-3e7ca635294ee417f664
Source of Spectrum B-33-119-0
Synonyms Methyl 1-(4-methylphenyl)-2-oxocyclohexanecarboxylate Methyl 2-oxo-1-(p-tolyl)cyclohexanecarboxylate
Wiley ID 1249155