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2-keto-6-phenyl-4-[2-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylic acid ethyl ester
SpectraBase Compound ID FkdRL2ngMhy
InChI InChI=1S/C22H20F3NO3/c1-2-29-21(28)20-16(14-8-4-3-5-9-14)12-15(13-19(20)27)26-18-11-7-6-10-17(18)22(23,24)25/h3-11,13,16,20,26H,2,12H2,1H3
InChIKey SKBWNLSKIXYEJF-UHFFFAOYSA-N
Mol Weight 403.4 g/mol
Molecular Formula C22H20F3NO3
Exact Mass 403.139528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CGFuE4NRYt0
Name 2-keto-6-phenyl-4-[2-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylic acid ethyl ester
Alternate Name(s) 2-Oxo-6-phenyl-4-[2-(trifluoromethyl)anilino]-1-cyclohex-3-enecarboxylic acid ethyl ester Ethyl 2-oxidanylidene-6-phenyl-4-[[2-(trifluoromethyl)phenyl]amino]cyclohex-3-ene-1-carboxylate Ethyl 2-oxo-6-phenyl-4-[2-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylate
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Formula C22H20F3NO3
InChI InChI=1S/C22H20F3NO3/c1-2-29-21(28)20-16(14-8-4-3-5-9-14)12-15(13-19(20)27)26-18-11-7-6-10-17(18)22(23,24)25/h3-11,13,16,20,26H,2,12H2,1H3
InChIKey SKBWNLSKIXYEJF-UHFFFAOYSA-N
Molecular Weight 403.401 g/mol
SMILES N(C=1CC(C(C(C1)=O)C(=O)OCC)c1ccccc1)c1ccccc1C(F)(F)F
SPLASH splash10-0ke9-5932000000-bba932ae292485405962
Wiley ID 1445379