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4-(4-Chlorophenyl)-2-methyl-4-oxobutanoic acid methyl ester

View entire compound with spectra: 1 MS (GC)

4-(4-Chlorophenyl)-2-methyl-4-oxobutanoic acid methyl ester
SpectraBase Compound ID 6FNiJgwaNF9
InChI InChI=1S/C12H13ClO3/c1-8(12(15)16-2)7-11(14)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3
InChIKey LYIMOFCGNVDHEY-UHFFFAOYSA-N
Mol Weight 240.69 g/mol
Molecular Formula C12H13ClO3
Exact Mass 240.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmCIURUK2cW
Name 4-(4-Chlorophenyl)-2-methyl-4-oxobutanoic acid methyl ester
Alternate Name(s) 4-(4-Chlorophenyl)-4-keto-2-methyl-butyric acid methyl ester Methyl 4-(4-chlorophenyl)-2-methyl-4-oxidanylidene-butanoate Methyl 4-(4-chlorophenyl)-2-methyl-4-oxo-butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClO3
InChI InChI=1S/C12H13ClO3/c1-8(12(15)16-2)7-11(14)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3
InChIKey LYIMOFCGNVDHEY-UHFFFAOYSA-N
Molecular Weight 240.686 g/mol
SMILES C(CC(C(=O)OC)C)(c1ccc(cc1)Cl)=O
SPLASH splash10-03dr-0910000000-8fce6fc9db05ae6c98f1
Source of Spectrum SK-31-207-3
Wiley ID 881708