2-[2-(4-Chlorophenyl)-2-oxoethyl]-5,5-dimethylcyclohexane-1,3-dione

SpectraBase Compound ID	BwbFvfCCB9k
InChI	InChI=1S/C16H17ClO3/c1-16(2)8-14(19)12(15(20)9-16)7-13(18)10-3-5-11(17)6-4-10/h3-6,12H,7-9H2,1-2H3
InChIKey	NTCRTCXBXPPSIS-UHFFFAOYSA-N Google Search
Mol Weight	292.76 g/mol
Molecular Formula	C16H17ClO3
Exact Mass	292.086622 g/mol

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SpectraBase Spectrum ID	J71PPGOaG9s
Name	2-[2-(4-Chlorophenyl)-2-oxoethyl]-5,5-dimethylcyclohexane-1,3-dione
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H17ClO3
InChI	InChI=1S/C16H17ClO3/c1-16(2)8-14(19)12(15(20)9-16)7-13(18)10-3-5-11(17)6-4-10/h3-6,12H,7-9H2,1-2H3
InChIKey	NTCRTCXBXPPSIS-UHFFFAOYSA-N
Literature Reference DOI	10.1248/cpb.c13-00003
Molecular Weight	292.762 g/mol
SMILES	C1(C(CC(CC1=O)(C)C)=O)CC(c1ccc(cc1)Cl)=O
SPLASH	splash10-000l-1950000000-3c6a2b7c7fdc9b39bb1b
Source of Spectrum	E1-62-21-13f
Synonyms	2-(2-(4-chlorophenyl)-2-oxoethyl)-5,5-dimethylcyclohexane-1,3-dione 2-[2-(4-chlorophenyl)-2-oxo-ethyl]-5,5-dimethyl-cyclohexane-1,3-dione 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-5,5-dimethyl-cyclohexane-1,3-dione
Wiley ID	1743594