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5-Pyrimidinecarboxylic acid, 4-(2,4-dimethylphenyl)-1,2,3,4-tetrahydro-6-methyl-2-thioxo-, ethyl ester
SpectraBase Compound ID 7DwfLKWoLBJ
InChI InChI=1S/C16H20N2O2S/c1-5-20-15(19)13-11(4)17-16(21)18-14(13)12-7-6-9(2)8-10(12)3/h6-8,14H,5H2,1-4H3,(H2,17,18,21)
InChIKey AYLVCYUTMGZYMP-UHFFFAOYSA-N
Mol Weight 304.41 g/mol
Molecular Formula C16H20N2O2S
Exact Mass 304.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bZ95aiYEK
Name 5-Pyrimidinecarboxylic acid, 4-(2,4-dimethylphenyl)-1,2,3,4-tetrahydro-6-methyl-2-thioxo-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O2S
InChI InChI=1S/C16H20N2O2S/c1-5-20-15(19)13-11(4)17-16(21)18-14(13)12-7-6-9(2)8-10(12)3/h6-8,14H,5H2,1-4H3,(H2,17,18,21)
InChIKey AYLVCYUTMGZYMP-UHFFFAOYSA-N
Molecular Weight 304.408 g/mol
SMILES N1C(NC(=C(C1c1c(cc(cc1)C)C)C(=O)OCC)C)=S
SPLASH splash10-0feb-3941000000-b4dc528dbab1c09ab48d
Source of Spectrum IY-1-4311-1
Synonyms 4-(2,4-dimethylphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Ethyl 4-(2,4-dimethylphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Ethyl 4-(2,4-dimethylphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Wiley ID 1651094