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4'-methylglutaranilic acid

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

4'-methylglutaranilic acid
SpectraBase Compound ID 69353oo9hfq
InChI InChI=1S/C12H15NO3/c1-9-5-7-10(8-6-9)13-11(14)3-2-4-12(15)16/h5-8H,2-4H2,1H3,(H,13,14)(H,15,16)
InChIKey YRPDUMZWXRBNJE-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CaQofjHXw4n
Name 4-p-Tolylcarbamoyl-butyric acid
Alternate Name(s) 5-(4-Methylanilino)-5-oxopentanoic acid 5-(4-Methylanilino)-5-oxo-pentanoic acid 5-[(4-methylphenyl)amino]-5-oxidanylidene-pentanoic acid
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Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-9-5-7-10(8-6-9)13-11(14)3-2-4-12(15)16/h5-8H,2-4H2,1H3,(H,13,14)(H,15,16)
InChIKey YRPDUMZWXRBNJE-UHFFFAOYSA-N
Molecular Weight 221.256 g/mol
SMILES N(C(CCCC(=O)O)=O)c1ccc(cc1)C
SPLASH splash10-0a4i-3910000000-f2613048e28c8f9f4b94
Source of Spectrum NP-5-3463-0
Wiley ID 1104788