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2-keto-6-(4-methoxyphenyl)-4-[3-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylic acid methyl ester
SpectraBase Compound ID 46ySW91mVLd
InChI InChI=1S/C22H20F3NO4/c1-29-17-8-6-13(7-9-17)18-11-16(12-19(27)20(18)21(28)30-2)26-15-5-3-4-14(10-15)22(23,24)25/h3-10,12,18,20,26H,11H2,1-2H3
InChIKey HWJJOBKUNHIIFR-UHFFFAOYSA-N
Mol Weight 419.4 g/mol
Molecular Formula C22H20F3NO4
Exact Mass 419.134443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qv6cQgVVbx
Name 2-keto-6-(4-methoxyphenyl)-4-[3-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylic acid methyl ester
Alternate Name(s) 6-(4-Methoxyphenyl)-2-oxo-4-[3-(trifluoromethyl)anilino]-1-cyclohex-3-enecarboxylic acid methyl ester Methyl 6-(4-methoxyphenyl)-2-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]amino]cyclohex-3-ene-1-carboxylate Methyl 6-(4-methoxyphenyl)-2-oxo-4-[3-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylate
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Formula C22H20F3NO4
InChI InChI=1S/C22H20F3NO4/c1-29-17-8-6-13(7-9-17)18-11-16(12-19(27)20(18)21(28)30-2)26-15-5-3-4-14(10-15)22(23,24)25/h3-10,12,18,20,26H,11H2,1-2H3
InChIKey HWJJOBKUNHIIFR-UHFFFAOYSA-N
Molecular Weight 419.400 g/mol
SMILES N(c1cccc(c1)C(F)(F)F)C=1CC(C(C(C1)=O)C(=O)OC)c1ccc(cc1)OC
SPLASH splash10-01t9-2964100000-e98b5842af96a51d002b
Wiley ID 1445402