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Methyl 4-(4-Chlorophenyl)acetoacetate
SpectraBase Compound ID 5KIP71Sqqnp
InChI InChI=1S/C11H11ClO3/c1-15-11(14)7-10(13)6-8-2-4-9(12)5-3-8/h2-5H,6-7H2,1H3
InChIKey CAZZOLHYAAIMBN-UHFFFAOYSA-N
Mol Weight 226.66 g/mol
Molecular Formula C11H11ClO3
Exact Mass 226.039672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMCLfJSrXDo
Name Methyl 4-(4-Chlorophenyl)acetoacetate
Alternate Name(s) 4-(4-Chlorophenyl)-3-oxobutanoic acid methyl ester Methyl 4-(4-chlorophenyl)-3-oxobutanoate Methyl 4-(4-chlorophenyl)-3-oxo-butanoate Methyl 4-(4-chlorophenyl)-3-oxidanylidene-butanoate
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Formula C11H11ClO3
InChI InChI=1S/C11H11ClO3/c1-15-11(14)7-10(13)6-8-2-4-9(12)5-3-8/h2-5H,6-7H2,1H3
InChIKey CAZZOLHYAAIMBN-UHFFFAOYSA-N
Molecular Weight 226.659 g/mol
SMILES C(C(=O)OC)C(=O)Cc1ccc(Cl)cc1
SPLASH splash10-004r-9250000000-9e72601c4a1e3b398138
Source of Spectrum F4-41-246-2d
Wiley ID 1671712