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Methyl 2-(4-bromobenzoyl)-3-oxobutanoate
SpectraBase Compound ID JO9wpOTKWfG
InChI InChI=1S/C12H11BrO4/c1-7(14)10(12(16)17-2)11(15)8-3-5-9(13)6-4-8/h3-6,10H,1-2H3
InChIKey DDAGPKPTZSVHAO-UHFFFAOYSA-N
Mol Weight 299.12 g/mol
Molecular Formula C12H11BrO4
Exact Mass 297.984072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HP9mk5mKV6o
Name Methyl 2-(4-bromobenzoyl)-3-oxobutanoate
Alternate Name(s) 2-(4-bromobenzoyl)-3-keto-butyric acid methyl ester 2-[(4-bromophenyl)-oxomethyl]-3-oxobutanoic acid methyl ester Methyl 2-(4-bromophenyl)carbonyl-3-oxidanylidene-butanoate Methyl acetyl(p-bromobenzoyl)acetate
CAS Registry Number 85963-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrO4
InChI InChI=1S/C12H11BrO4/c1-7(14)10(12(16)17-2)11(15)8-3-5-9(13)6-4-8/h3-6,10H,1-2H3
InChIKey DDAGPKPTZSVHAO-UHFFFAOYSA-N
Molecular Weight 299.120 g/mol
SMILES C(C(c1ccc(cc1)Br)=O)(C(=O)OC)C(=O)C
SPLASH splash10-0569-9810000000-bacc5ad725ba3f4219b5
Source of Spectrum AD-0-2532-0
Wiley ID 1430190