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6-Methyl-4-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester
SpectraBase Compound ID Gp4wLCC24HO
InChI InChI=1S/C14H16N2O2S/c1-8-4-6-10(7-5-8)12-11(13(17)18-3)9(2)15-14(19)16-12/h4-7,12H,1-3H3,(H2,15,16,19)
InChIKey JPNGAFIAIFDDHB-UHFFFAOYSA-N
Mol Weight 276.35 g/mol
Molecular Formula C14H16N2O2S
Exact Mass 276.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Q4fEP0GuW
Name 6-Methyl-4-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester
Alternate Name(s) 6-Methyl-4-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Methyl 6-methyl-4-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Methyl 6-methyl-4-(4-methylphenyl)-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate Methyl 6-methyl-4-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
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Formula C14H16N2O2S
InChI InChI=1S/C14H16N2O2S/c1-8-4-6-10(7-5-8)12-11(13(17)18-3)9(2)15-14(19)16-12/h4-7,12H,1-3H3,(H2,15,16,19)
InChIKey JPNGAFIAIFDDHB-UHFFFAOYSA-N
Molecular Weight 276.354 g/mol
SMILES N1C(NC(C(=C1C)C(=O)OC)c1ccc(cc1)C)=S
SPLASH splash10-004r-1590000000-4c137f432679c2d21637
Source of Spectrum D8-324-137-3
Wiley ID 1514036