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2-(4-isobutylphenyl)-3-keto-butyric acid methyl ester
SpectraBase Compound ID LWj3m04QMP1
InChI InChI=1S/C15H20O3/c1-10(2)9-12-5-7-13(8-6-12)14(11(3)16)15(17)18-4/h5-8,10,14H,9H2,1-4H3
InChIKey AYANBIJLPYFFAO-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pKuKRCDxcs
Name 2-(4-isobutylphenyl)-3-keto-butyric acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-10(2)9-12-5-7-13(8-6-12)14(11(3)16)15(17)18-4/h5-8,10,14H,9H2,1-4H3
InChIKey AYANBIJLPYFFAO-UHFFFAOYSA-N
Molecular Weight 248.322 g/mol
SMILES C(C(=O)OC)(C(=O)C)c1ccc(cc1)CC(C)C
SPLASH splash10-052e-1900000000-2479b7a8d05594a90a88
Source of Spectrum F-51-10048-1
Synonyms 2-[4-(2-methylpropyl)phenyl]-3-oxobutanoic acid methyl ester Methyl 2-(4-isobutylphenyl)-3-oxo-butanoate Methyl 2-[4-(2-methylpropyl)phenyl]-3-oxidanylidene-butanoate Methyl 2-[4-(2-methylpropyl)phenyl]-3-oxobutanoate
Wiley ID 793366