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3-ethyl-7,9-dimethyl-1H-purino[8,7-c][1,2,4]triazine-4,6,8-trione
SpectraBase Compound ID S3ukiidko3
InChI InChI=1S/C11H12N6O3/c1-4-5-8(18)17-6-7(12-10(17)14-13-5)15(2)11(20)16(3)9(6)19/h4H2,1-3H3,(H,12,14)
InChIKey XXVSOAOVXMMIQU-UHFFFAOYSA-N
Mol Weight 276.26 g/mol
Molecular Formula C11H12N6O3
Exact Mass 276.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VyBuhAcEgG
Name 3-ethyl-7,9-dimethyl-1H-purino[8,7-c][1,2,4]triazine-4,6,8-trione
Comments Less than 3 mono-isotopic peaks
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Formula C11H12N6O3
InChI InChI=1S/C11H12N6O3/c1-4-5-8(18)17-6-7(12-10(17)14-13-5)15(2)11(20)16(3)9(6)19/h4H2,1-3H3,(H,12,14)
InChIKey XXVSOAOVXMMIQU-UHFFFAOYSA-N
Molecular Weight 276.256 g/mol
SMILES N1N=C(C([n]2c1nc1c2C(N(C(N1C)=O)C)=O)=O)CC
SPLASH splash10-004i-1090000000-5bdbe5cfc1b8ff5290da
Source of Spectrum Y-38-611-5
Wiley ID 848356