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7,7-Dimethyl-4-(3-thienyl)-1-[2-(trifluoromethyl)phenyl]-3,4,6,8-tetrahydroquinoline-2,5-dione
SpectraBase Compound ID Igw6Jkwzcw8
InChI InChI=1S/C22H20F3NO2S/c1-21(2)10-17-20(18(27)11-21)14(13-7-8-29-12-13)9-19(28)26(17)16-6-4-3-5-15(16)22(23,24)25/h3-8,12,14H,9-11H2,1-2H3
InChIKey AAJLGFYGKJVDOC-UHFFFAOYSA-N
Mol Weight 419.46 g/mol
Molecular Formula C22H20F3NO2S
Exact Mass 419.116685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5ZmdDKSvXH
Name 7,7-Dimethyl-4-(3-thienyl)-1-[2-(trifluoromethyl)phenyl]-3,4,6,8-tetrahydroquinoline-2,5-dione
Alternate Name(s) 7,7-Dimethyl-4-(3-thienyl)-1-[2-(trifluoromethyl)phenyl]-3,4,6,8-tetrahydroquinoline-2,5-quinone 7,7-Dimethyl-4-(3-thiophenyl)-1-[2-(trifluoromethyl)phenyl]-3,4,6,8-tetrahydroquinoline-2,5-dione 7,7-Dimethyl-4-thiophen-3-yl-1-[2-(trifluoromethyl)phenyl]-3,4,6,8-tetrahydroquinoline-2,5-dione
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Formula C22H20F3NO2S
InChI InChI=1S/C22H20F3NO2S/c1-21(2)10-17-20(18(27)11-21)14(13-7-8-29-12-13)9-19(28)26(17)16-6-4-3-5-15(16)22(23,24)25/h3-8,12,14H,9-11H2,1-2H3
InChIKey AAJLGFYGKJVDOC-UHFFFAOYSA-N
Molecular Weight 419.462 g/mol
SMILES c1(c(N2C=3CC(CC(=O)C3C(CC2=O)c2cscc2)(C)C)cccc1)C(F)(F)F
SPLASH splash10-016u-3329400000-ca839f8249e6c6a73bb4
Wiley ID 1445362