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3-(p-toluoyl)propionic acid

View entire compound with spectra: 6 NMR, 1 FTIR, 1 UV-Vis, and 3 MS (GC)

3-(p-toluoyl)propionic acid
SpectraBase Compound ID 6B2FLlNXGHO
InChI InChI=1S/C11H12O3/c1-8-2-4-9(5-3-8)10(12)6-7-11(13)14/h2-5H,6-7H2,1H3,(H,13,14)
InChIKey OEEUWZITKKSXAZ-UHFFFAOYSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kr9a7UzCve7
Name 4-Oxo-4-p-tolylbutyric acid
Alternate Name(s) 3-(4-Methylbenzoyl)propionic acid 4-(4-Methylphenyl)-4-oxidanylidene-butanoic acid 4-(4-Methylphenyl)-4-oxobutanoic acid 4-keto-4-(p-tolyl)butyric acid 4-Oxo-4-(p-tolyl)butanoic acid 4-Oxo-4-(para-tolyl)-butyric acid
CAS Registry Number 4619-20-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-8-2-4-9(5-3-8)10(12)6-7-11(13)14/h2-5H,6-7H2,1H3,(H,13,14)
InChIKey OEEUWZITKKSXAZ-UHFFFAOYSA-N
Molecular Weight 192.214 g/mol
SMILES OC(=O)CCC(c1ccc(cc1)C)=O
SPLASH splash10-014l-9700000000-22eac1150d5676165290
Wiley ID 1474633