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3-(2-mercaptopropyl)-5,6-dimethyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
SpectraBase Compound ID 3QEqEId4Xke
InChI InChI=1S/C11H14N2O2S2/c1-5(16)4-13-10(14)8-6(2)7(3)17-9(8)12-11(13)15/h5,16H,4H2,1-3H3,(H,12,15)
InChIKey CMHCBEAWYLLCPK-UHFFFAOYSA-N
Mol Weight 270.36 g/mol
Molecular Formula C11H14N2O2S2
Exact Mass 270.04967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjPzniK0ALE
Name 3-(2-mercaptopropyl)-5,6-dimethyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
Alternate Name(s) 3-(2-mercaptopropyl)-5,6-dimethyl-1H-thieno[2,3-d]pyrimidine-2,4-quinone 5,6-Dimethyl-3-(2-sulfanylpropyl)-1H-thieno[2,3-d]pyrimidine-2,4-dione
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Formula C11H14N2O2S2
InChI InChI=1S/C11H14N2O2S2/c1-5(16)4-13-10(14)8-6(2)7(3)17-9(8)12-11(13)15/h5,16H,4H2,1-3H3,(H,12,15)
InChIKey CMHCBEAWYLLCPK-UHFFFAOYSA-N
Molecular Weight 270.365 g/mol
SMILES N1C(N(CC(S)C)C(c2c(c(C)sc12)C)=O)=O
SPLASH splash10-0uea-0900000000-dba40ccdd93ce1e24d61
Source of Spectrum D8-328-232-3
Wiley ID 1515757