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Methyl 1-benzyl-2-oxocyclohexanecarboxylate

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Methyl 1-benzyl-2-oxocyclohexanecarboxylate
SpectraBase Compound ID BoeH7XmJkkn
InChI InChI=1S/C15H18O3/c1-18-14(17)15(10-6-5-9-13(15)16)11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3
InChIKey HCMBZQZUCUJZDB-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 DGep0lnuAJd
Name Methyl 1-benzyl-2-oxocyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-18-14(17)15(10-6-5-9-13(15)16)11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3
InChIKey HCMBZQZUCUJZDB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200600355
Molecular Weight 246.306 g/mol
SMILES C1(C(OC)=O)(C(CCCC1)=O)Cc1ccccc1
SPLASH splash10-00kf-9710000000-b8e293ecdb9d6682883b
Source of Spectrum ASC-349-432/SM15-24a
Synonyms 2-Oxo-1-(phenylmethyl)-1-cyclohexanecarboxylic acid methyl ester Methyl 1-benzyl-2-oxocyclohexane-1-carboxylate Methyl 1-benzyl-2-oxo-cyclohexanecarboxylate Methyl 2-oxidanylidene-1-(phenylmethyl)cyclohexane-1-carboxylate
Wiley ID 1765476