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4-quinolinecarboxylic acid, 3-(ethylthio)-2-phenyl-

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

4-quinolinecarboxylic acid, 3-(ethylthio)-2-phenyl-
SpectraBase Compound ID 5cKYIKichW4
InChI InChI=1S/C18H15NO2S/c1-2-22-17-15(18(20)21)13-10-6-7-11-14(13)19-16(17)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,20,21)
InChIKey YBZPEAFFNFMQMT-UHFFFAOYSA-N
Mol Weight 309.38 g/mol
Molecular Formula C18H15NO2S
Exact Mass 309.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0nOChn1x5s
Name Quinoline-4-carboxylic acid, 3-ethylthio-2-phenyl-
Alternate Name(s) 3-(Ethylsulfanyl)-2-phenyl-4-quinolinecarboxylic acid 3-(ethylthio)-2-phenyl-4-quinolinecarboxylic acid 3-(ethylthio)-2-phenyl-cinchoninic acid 3-Ethylsulfanyl-2-phenyl-quinoline-4-carboxylic acid
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Formula C18H15NO2S
InChI InChI=1S/C18H15NO2S/c1-2-22-17-15(18(20)21)13-10-6-7-11-14(13)19-16(17)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,20,21)
InChIKey YBZPEAFFNFMQMT-UHFFFAOYSA-N
Molecular Weight 309.383 g/mol
SMILES OC(c1c(c(-c2ccccc2)nc2c1cccc2)SCC)=O
SPLASH splash10-0540-4392000000-93e07c0092518164d773
Wiley ID 1457358