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4-(2,4-dichlorophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
SpectraBase Compound ID 85jX6Dd7ckO
InChI InChI=1S/C14H14Cl2N2O3/c1-3-21-13(19)11-7(2)17-14(20)18-12(11)9-5-4-8(15)6-10(9)16/h4-6,12H,3H2,1-2H3,(H2,17,18,20)
InChIKey TZGBGBGJHQURTE-UHFFFAOYSA-N
Mol Weight 329.18 g/mol
Molecular Formula C14H14Cl2N2O3
Exact Mass 328.038148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5y40KQJ44p
Name 4-(2,4-dichlorophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
Alternate Name(s) 4-(2,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Ethyl 4-(2,4-dichlorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Ethyl 4-(2,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate Ethyl 4-(2,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate Ethyl 4-(2,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H14Cl2N2O3
InChI InChI=1S/C14H14Cl2N2O3/c1-3-21-13(19)11-7(2)17-14(20)18-12(11)9-5-4-8(15)6-10(9)16/h4-6,12H,3H2,1-2H3,(H2,17,18,20)
InChIKey TZGBGBGJHQURTE-UHFFFAOYSA-N
Molecular Weight 329.183 g/mol
SMILES N1C(C(=C(NC1=O)C)C(=O)OCC)c1c(cc(cc1)Cl)Cl
SPLASH splash10-001i-0900000000-1fc7648975bd44734305
Source of Spectrum J-65-3867-7
Wiley ID 1532342