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4-(3-fluoroanilino)-2-keto-6-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester
SpectraBase Compound ID 7OUknnlrZoh
InChI InChI=1S/C21H20FNO3/c1-2-26-21(25)20-18(14-7-4-3-5-8-14)12-17(13-19(20)24)23-16-10-6-9-15(22)11-16/h3-11,13,18,20,23H,2,12H2,1H3
InChIKey SYAGWLMWYQBCBM-UHFFFAOYSA-N
Mol Weight 353.39 g/mol
Molecular Formula C21H20FNO3
Exact Mass 353.142722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COML9ylP023
Name 4-(3-fluoroanilino)-2-keto-6-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester
Alternate Name(s) 4-(3-fluoroanilino)-2-oxo-6-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester Ethyl 4-(3-fluoroanilino)-2-oxo-6-phenyl-cyclohex-3-ene-1-carboxylate Ethyl 4-[(3-fluorophenyl)amino]-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate
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Formula C21H20FNO3
InChI InChI=1S/C21H20FNO3/c1-2-26-21(25)20-18(14-7-4-3-5-8-14)12-17(13-19(20)24)23-16-10-6-9-15(22)11-16/h3-11,13,18,20,23H,2,12H2,1H3
InChIKey SYAGWLMWYQBCBM-UHFFFAOYSA-N
Molecular Weight 353.393 g/mol
SMILES N(C=1CC(C(C(C1)=O)C(=O)OCC)c1ccccc1)c1cccc(c1)F
SPLASH splash10-0fc0-1943000000-550a90b6028faea91469
Wiley ID 1511529