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6-amino-1,3-dimethyl-5-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)pyrimidine-2,4-dione
SpectraBase Compound ID FBcqoaXcikB
InChI InChI=1S/C13H19N5O2S/c1-7-6-13(2,3)15-11(21)18(7)8-9(14)16(4)12(20)17(5)10(8)19/h6H,14H2,1-5H3,(H,15,21)
InChIKey QHUQASQCOWXVEG-UHFFFAOYSA-N
Mol Weight 309.39 g/mol
Molecular Formula C13H19N5O2S
Exact Mass 309.125946 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FtkbcYicPN
Name 6-amino-1,3-dimethyl-5-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)pyrimidine-2,4-dione
Comments Less than 3 mono-isotopic peaks
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Formula C13H19N5O2S
InChI InChI=1S/C13H19N5O2S/c1-7-6-13(2,3)15-11(21)18(7)8-9(14)16(4)12(20)17(5)10(8)19/h6H,14H2,1-5H3,(H,15,21)
InChIKey QHUQASQCOWXVEG-UHFFFAOYSA-N
Molecular Weight 309.388 g/mol
SMILES NC1=C(N2C(NC(C=C2C)(C)C)=S)C(N(C(N1C)=O)C)=O
SPLASH splash10-0006-0090000000-970fa5c3e15d6da18938
Source of Spectrum B-54-73-14
Synonyms 6-amino-1,3-dimethyl-5-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)pyrimidine-2,4-dione 6-amino-1,3-dimethyl-5-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)pyrimidine-2,4-quinone 6-azanyl-1,3-dimethyl-5-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)pyrimidine-2,4-dione
Wiley ID 811093