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4-(2-Chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester
SpectraBase Compound ID ECF4cBufWyQ
InChI InChI=1S/C13H13ClN2O2S/c1-7-10(12(17)18-2)11(16-13(19)15-7)8-5-3-4-6-9(8)14/h3-6,11H,1-2H3,(H2,15,16,19)
InChIKey IGCFTBUKAOHMJB-UHFFFAOYSA-N
Mol Weight 296.77 g/mol
Molecular Formula C13H13ClN2O2S
Exact Mass 296.038627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oOA2IdC7pd
Name 4-(2-Chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O2S
InChI InChI=1S/C13H13ClN2O2S/c1-7-10(12(17)18-2)11(16-13(19)15-7)8-5-3-4-6-9(8)14/h3-6,11H,1-2H3,(H2,15,16,19)
InChIKey IGCFTBUKAOHMJB-UHFFFAOYSA-N
Molecular Weight 296.772 g/mol
SMILES N1C(NC(=C(C1c1c(Cl)cccc1)C(=O)OC)C)=S
SPLASH splash10-000j-0890000000-a1411f289e0b7ed97bc6
Source of Spectrum D8-324-137-3
Synonyms 4-(2-Chlorophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Methyl 4-(2-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Methyl 4-(2-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate Methyl 4-(2-chlorophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Wiley ID 1514034