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2-(ethylsulfanyl)ethyl 2-methyl-5-oxo-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID BcEf1huumuN
InChI InChI=1S/C26H26F3NO3S2/c1-3-34-12-10-33-25(32)22-15(2)30-19-13-17(21-5-4-11-35-21)14-20(31)24(19)23(22)16-6-8-18(9-7-16)26(27,28)29/h4-9,11,17,23,30H,3,10,12-14H2,1-2H3
InChIKey QUWGOVYSMZXZNC-UHFFFAOYSA-N
Mol Weight 521.61 g/mol
Molecular Formula C26H26F3NO3S2
Exact Mass 521.130621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzFDROGd9A7
Name 2-(ethylsulfanyl)ethyl 2-methyl-5-oxo-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Alternate Name(s) 2-Ethylsulfanylethyl 2-methyl-5-oxidanylidene-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate 2-Ethylsulfanylethyl 2-methyl-5-oxo-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate 2-Ethylsulfanylethyl 2-methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate 2-Methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester 5-keto-2-methyl-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester
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Formula C26H26F3NO3S2
InChI InChI=1S/C26H26F3NO3S2/c1-3-34-12-10-33-25(32)22-15(2)30-19-13-17(21-5-4-11-35-21)14-20(31)24(19)23(22)16-6-8-18(9-7-16)26(27,28)29/h4-9,11,17,23,30H,3,10,12-14H2,1-2H3
InChIKey QUWGOVYSMZXZNC-UHFFFAOYSA-N
Molecular Weight 521.613 g/mol
SMILES N1C2=C(C(C(=C1C)C(=O)OCCSCC)c1ccc(C(F)(F)F)cc1)C(CC(C2)c1sccc1)=O
SPLASH splash10-01p9-9310000000-4fccc06cebad1fc8c653
Wiley ID 1464699