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5-Acetyl-2-thioxo-dihydro-pyrimidine-4,6-dione
SpectraBase Compound ID HkCbRunwKC1
InChI InChI=1S/C6H6N2O3S/c1-2(9)3-4(10)7-6(12)8-5(3)11/h3H,1H3,(H2,7,8,10,11,12)
InChIKey QFNRROFKXIZJGJ-UHFFFAOYSA-N
Mol Weight 186.19 g/mol
Molecular Formula C6H6N2O3S
Exact Mass 186.009913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Adb5EcAqwJ3
Name 5-Acetyl-2-thioxo-dihydro-pyrimidine-4,6-dione
Alternate Name(s) 5-Acetyl-2-sulfanylidene-1,3-diazinane-4,6-dione 5-Acetyl-2-thioxo-hexahydropyrimidine-4,6-dione 5-Acetyl-2-thioxo-hexahydropyrimidine-4,6-quinone 5-Ethanoyl-2-sulfanylidene-1,3-diazinane-4,6-dione
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Formula C6H6N2O3S
InChI InChI=1S/C6H6N2O3S/c1-2(9)3-4(10)7-6(12)8-5(3)11/h3H,1H3,(H2,7,8,10,11,12)
InChIKey QFNRROFKXIZJGJ-UHFFFAOYSA-N
Molecular Weight 186.185 g/mol
SMILES N1C(NC(=O)C(C1=O)C(=O)C)=S
SPLASH splash10-000i-3900000000-be7d3f9aefae8acbdf53
Wiley ID 1465341