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4-(3-bromo-4,5-dimethoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
SpectraBase Compound ID 3mircQy81m9
InChI InChI=1S/C16H19BrN2O5/c1-5-24-15(20)12-8(2)18-16(21)19-13(12)9-6-10(17)14(23-4)11(7-9)22-3/h6-7,13H,5H2,1-4H3,(H2,18,19,21)
InChIKey NRLLGGFVNSBKIJ-UHFFFAOYSA-N
Mol Weight 399.24 g/mol
Molecular Formula C16H19BrN2O5
Exact Mass 398.047735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhHNWSRiK1D
Name 4-(3-bromo-4,5-dimethoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
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Formula C16H19BrN2O5
InChI InChI=1S/C16H19BrN2O5/c1-5-24-15(20)12-8(2)18-16(21)19-13(12)9-6-10(17)14(23-4)11(7-9)22-3/h6-7,13H,5H2,1-4H3,(H2,18,19,21)
InChIKey NRLLGGFVNSBKIJ-UHFFFAOYSA-N
Molecular Weight 399.241 g/mol
SMILES N1C(NC(=C(C1c1cc(Br)c(c(c1)OC)OC)C(=O)OCC)C)=O
SPLASH splash10-001i-6924000000-b8572281770ce9e88c03
Synonyms 4-(3-bromo-4,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Ethyl 4-(3-bromanyl-4,5-dimethoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Ethyl 4-(3-bromo-4,5-dimethoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Wiley ID 1462860