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2-Methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
SpectraBase Compound ID BQMQOlZGpVg
InChI InChI=1S/C23H20F3NO3S/c1-12-19(22(29)30-2)20(13-5-7-15(8-6-13)23(24,25)26)21-16(27-12)10-14(11-17(21)28)18-4-3-9-31-18/h3-9,14,20,27H,10-11H2,1-2H3
InChIKey FOXLSVCGCITMAQ-UHFFFAOYSA-N
Mol Weight 447.47 g/mol
Molecular Formula C23H20F3NO3S
Exact Mass 447.111599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ShF1pC3jle
Name 2-Methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20F3NO3S
InChI InChI=1S/C23H20F3NO3S/c1-12-19(22(29)30-2)20(13-5-7-15(8-6-13)23(24,25)26)21-16(27-12)10-14(11-17(21)28)18-4-3-9-31-18/h3-9,14,20,27H,10-11H2,1-2H3
InChIKey FOXLSVCGCITMAQ-UHFFFAOYSA-N
Molecular Weight 447.472 g/mol
SMILES N1C2=C(C(C(=C1C)C(=O)OC)c1ccc(C(F)(F)F)cc1)C(CC(C2)c1sccc1)=O
SPLASH splash10-0udi-1429300000-ea0ce6da7fa95eb848aa
Synonyms 5-keto-2-methyl-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester Methyl 2-methyl-5-oxidanylidene-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Methyl 2-methyl-5-oxo-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate Methyl 2-methyl-5-oxo-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Methyl 2-methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Wiley ID 1461729