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4-(3-Fluoro-phenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-methylsulfanyl-ethyl ester
SpectraBase Compound ID AoUIOF17Itn
InChI InChI=1S/C15H17FN2O3S/c1-9-12(14(19)21-6-7-22-2)13(18-15(20)17-9)10-4-3-5-11(16)8-10/h3-5,8,13H,6-7H2,1-2H3,(H2,17,18,20)
InChIKey WEDATKQJJXTLMG-UHFFFAOYSA-N
Mol Weight 324.37 g/mol
Molecular Formula C15H17FN2O3S
Exact Mass 324.094392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0tLlVYsYqC
Name 4-(3-Fluoro-phenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-methylsulfanyl-ethyl ester
Alternate Name(s) 2-(Methylsulfanyl)ethyl 4-(3-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate 2-Methylsulfanylethyl 4-(3-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate 2-Methylsulfanylethyl 4-(3-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate 4-(3-fluorophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester 4-(3-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester
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Formula C15H17FN2O3S
InChI InChI=1S/C15H17FN2O3S/c1-9-12(14(19)21-6-7-22-2)13(18-15(20)17-9)10-4-3-5-11(16)8-10/h3-5,8,13H,6-7H2,1-2H3,(H2,17,18,20)
InChIKey WEDATKQJJXTLMG-UHFFFAOYSA-N
Molecular Weight 324.370 g/mol
SMILES N1C(NC(=C(C1c1cc(F)ccc1)C(=O)OCCSC)C)=O
SPLASH splash10-004i-9210000000-20a44feb7cc2fdbf9d47
Wiley ID 1462857