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2',6'-dimethylsuccinanilic acid

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

2',6'-dimethylsuccinanilic acid
SpectraBase Compound ID LBMIMNDli2G
InChI InChI=1S/C12H15NO3/c1-8-4-3-5-9(2)12(8)13-10(14)6-7-11(15)16/h3-5H,6-7H2,1-2H3,(H,13,14)(H,15,16)
InChIKey ANORGLROOXVGGO-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 gexAuo3aC
Name 4-(2,6-Dimethylanilino)-4-oxobutanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-8-4-3-5-9(2)12(8)13-10(14)6-7-11(15)16/h3-5H,6-7H2,1-2H3,(H,13,14)(H,15,16)
InChIKey ANORGLROOXVGGO-UHFFFAOYSA-N
Molecular Weight 221.256 g/mol
SMILES N(c1c(cccc1C)C)C(CCC(=O)O)=O
SPLASH splash10-05fv-9400000000-ef6ee30090aeac54f013
Synonyms 4-(2,6-dimethylanilino)-4-keto-butyric acid 4-[(2,6-dimethylphenyl)amino]-4-oxidanylidene-butanoic acid
Wiley ID 1450806