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3-Amino-6-acetyl-5-methyl-2-thioxo-thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID 9HyvUporgDm
InChI InChI=1S/C9H9N3O2S2/c1-3-5-7(16-6(3)4(2)13)11-9(15)12(10)8(5)14/h10H2,1-2H3,(H,11,15)
InChIKey ZRNAONCDUKEEKD-UHFFFAOYSA-N
Mol Weight 255.31 g/mol
Molecular Formula C9H9N3O2S2
Exact Mass 255.013619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76EzWnhbXKK
Name 3-Amino-6-acetyl-5-methyl-2-thioxo-thieno[2,3-d]pyrimidin-4-one
Alternate Name(s) 6-acetyl-3-amino-5-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one 3-azanyl-6-ethanoyl-5-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3O2S2
InChI InChI=1S/C9H9N3O2S2/c1-3-5-7(16-6(3)4(2)13)11-9(15)12(10)8(5)14/h10H2,1-2H3,(H,11,15)
InChIKey ZRNAONCDUKEEKD-UHFFFAOYSA-N
Molecular Weight 255.310 g/mol
SMILES N1C(N(C(c2c1sc(c2C)C(=O)C)=O)N)=S
SPLASH splash10-0a4i-0090000000-1d6c7307990d66686ad8
Source of Spectrum F2-45-1490-5b
Wiley ID 1703318