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3-(2-keto-4-methyl-1H-quinolin-3-yl)propionic acid

View entire compound with spectra: 2 MS (GC)

3-(2-keto-4-methyl-1H-quinolin-3-yl)propionic acid
SpectraBase Compound ID AfoHW0LSZGP
InChI InChI=1S/C13H13NO3/c1-8-9-4-2-3-5-11(9)14-13(17)10(8)6-7-12(15)16/h2-5H,6-7H2,1H3,(H,14,17)(H,15,16)
InChIKey INDBCVKRYIAIQP-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QlcaO5Ym0
Name 3-(2-keto-4-methyl-1H-quinolin-3-yl)propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-8-9-4-2-3-5-11(9)14-13(17)10(8)6-7-12(15)16/h2-5H,6-7H2,1H3,(H,14,17)(H,15,16)
InChIKey INDBCVKRYIAIQP-UHFFFAOYSA-N
Molecular Weight 231.251 g/mol
SMILES Oc1c(CCC(=O)O)c(c2c(n1)cccc2)C
SPLASH splash10-0019-2910000000-0f6459001fe26d1c1e7f
Synonyms 3-(4-Methyl-2-oxo-1,2-dihydroquinolin-3-yl)propanoic acid 3-(4-Methyl-2-oxo-1H-quinolin-3-yl)propanoic acid 3-(4-Methyl-2-oxidanylidene-1H-quinolin-3-yl)propanoic acid Propionic acid, 3-(2-hydroxy-4-methylquinolin-3-yl)-
Wiley ID 1441904