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4-(2-Chloro-6-fluoro-phenyl)-1-methyl-2-oxo-6-phenyl-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester
SpectraBase Compound ID At0HMTKZc2Y
InChI InChI=1S/C20H18ClFN2O3/c1-3-27-19(25)16-17(15-13(21)10-7-11-14(15)22)23-20(26)24(2)18(16)12-8-5-4-6-9-12/h4-11,17H,3H2,1-2H3,(H,23,26)
InChIKey ODXVNZSQLYDHMF-UHFFFAOYSA-N
Mol Weight 388.83 g/mol
Molecular Formula C20H18ClFN2O3
Exact Mass 388.098998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hg01dfVS79o
Name 4-(2-Chloro-6-fluoro-phenyl)-1-methyl-2-oxo-6-phenyl-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester
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Formula C20H18ClFN2O3
InChI InChI=1S/C20H18ClFN2O3/c1-3-27-19(25)16-17(15-13(21)10-7-11-14(15)22)23-20(26)24(2)18(16)12-8-5-4-6-9-12/h4-11,17H,3H2,1-2H3,(H,23,26)
InChIKey ODXVNZSQLYDHMF-UHFFFAOYSA-N
Molecular Weight 388.826 g/mol
SMILES N1C(C(=C(N(C1=O)C)c1ccccc1)C(=O)OCC)c1c(F)cccc1Cl
SPLASH splash10-0aor-1579000000-7e9b6c61fd0e825db586
Synonyms 6-(2-Chloro-6-fluoro-phenyl)-2-keto-3-methyl-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester 6-(2-Chloro-6-fluorophenyl)-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Ethyl 4-(2-chloro-6-fluorophenyl)-1-methyl-2-oxo-6-phenyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate Ethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-3-methyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Ethyl 6-(2-chloro-6-fluoro-phenyl)-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate
Wiley ID 1461447