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Pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-6-methyl-4-(3-pyridyl)-2-thioxo-, ethyl ester
SpectraBase Compound ID KuooicYCdv
InChI InChI=1S/C13H15N3O2S/c1-3-18-12(17)10-8(2)15-13(19)16-11(10)9-5-4-6-14-7-9/h4-7,11H,3H2,1-2H3,(H2,15,16,19)
InChIKey JPYRFQAGJBOJFZ-UHFFFAOYSA-N
Mol Weight 277.34 g/mol
Molecular Formula C13H15N3O2S
Exact Mass 277.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Abjg9e6qwBP
Name Pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-6-methyl-4-(3-pyridyl)-2-thioxo-, ethyl ester
Alternate Name(s) 6-Methyl-4-(3-pyridinyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester 6-Methyl-4-(3-pyridyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Ethyl 6-methyl-4-(3-pyridinyl)-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate Ethyl 6-methyl-4-(3-pyridyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Ethyl 6-methyl-4-pyridin-3-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
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Formula C13H15N3O2S
InChI InChI=1S/C13H15N3O2S/c1-3-18-12(17)10-8(2)15-13(19)16-11(10)9-5-4-6-14-7-9/h4-7,11H,3H2,1-2H3,(H2,15,16,19)
InChIKey JPYRFQAGJBOJFZ-UHFFFAOYSA-N
Molecular Weight 277.342 g/mol
SMILES N1C(NC(C(=C1C)C(=O)OCC)c1cnccc1)=S
SPLASH splash10-0f95-9520000000-4fd9d05f235d525e80df
Wiley ID 1439323