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5-Methyl-6-(phenylthio)pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID APkeuT1ZtGR
InChI InChI=1S/C11H10N2O2S/c1-7-9(14)12-11(15)13-10(7)16-8-5-3-2-4-6-8/h2-6H,1H3,(H2,12,13,14,15)
InChIKey CTOOWBUBIRWOGC-UHFFFAOYSA-N
Mol Weight 234.27 g/mol
Molecular Formula C11H10N2O2S
Exact Mass 234.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HkCw8WoAkY
Name 5-Methyl-6-(phenylthio)pyrimidine-2,4(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2O2S
InChI InChI=1S/C11H10N2O2S/c1-7-9(14)12-11(15)13-10(7)16-8-5-3-2-4-6-8/h2-6H,1H3,(H2,12,13,14,15)
InChIKey CTOOWBUBIRWOGC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol063136w
Molecular Weight 234.273 g/mol
SMILES N1C(=O)NC(Sc2ccccc2)=C(C)C1=O
SPLASH splash10-001i-3490000000-6d4e835bebbdb98611ae
Source of Spectrum A1-9-1639/SMS34-8
Synonyms 5-Methyl-6-(phenylthio)-1H-pyrimidine-2,4-dione 5-Methyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione
Wiley ID 1757970