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2-(4-isobutyrylphenyl)-3-keto-butyric acid methyl ester
SpectraBase Compound ID BlPZtBaeTyd
InChI InChI=1S/C15H18O4/c1-9(2)14(17)12-7-5-11(6-8-12)13(10(3)16)15(18)19-4/h5-9,13H,1-4H3
InChIKey VYTALXNIJXEOCT-UHFFFAOYSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAOPohtvET3
Name 2-(4-isobutyrylphenyl)-3-keto-butyric acid methyl ester
Alternate Name(s) 2-[4-(2-methyl-1-oxopropyl)phenyl]-3-oxobutanoic acid methyl ester Methyl 2-[4-(2-methylpropanoyl)phenyl]-3-oxidanylidene-butanoate Methyl 2-[4-(2-methylpropanoyl)phenyl]-3-oxo-butanoate
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Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-9(2)14(17)12-7-5-11(6-8-12)13(10(3)16)15(18)19-4/h5-9,13H,1-4H3
InChIKey VYTALXNIJXEOCT-UHFFFAOYSA-N
Molecular Weight 262.305 g/mol
SMILES C(C(=O)OC)(C(=O)C)c1ccc(C(=O)C(C)C)cc1
SPLASH splash10-03di-2900000000-a9863bb2bf5dc8319841
Source of Spectrum F-50-8124-13
Wiley ID 1265938