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1,3-Dimethyl-7-(2-pyridinylmethyl)purine-2,6-dione
SpectraBase Compound ID 8Z0BeCnA4h0
InChI InChI=1S/C13H13N5O2/c1-16-11-10(12(19)17(2)13(16)20)18(8-15-11)7-9-5-3-4-6-14-9/h3-6,8H,7H2,1-2H3
InChIKey NNKLCVWXYDDDDG-UHFFFAOYSA-N
Mol Weight 271.28 g/mol
Molecular Formula C13H13N5O2
Exact Mass 271.106925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KKWl3Zan4K
Name 1,3-Dimethyl-7-(2-pyridinylmethyl)purine-2,6-dione
Alternate Name(s) 1,3-Dimethyl-7-(2-pyridylmethyl)purine-2,6-dione 1,3-Dimethyl-7-(2-pyridylmethyl)xanthine 1,3-Dimethyl-7-(pyridin-2-ylmethyl)purine-2,6-dione 3,7-Dihydropurine-2,6-dione, 1,3-dimethyl-7-pyridin-2-ylmethyl-
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Formula C13H13N5O2
InChI InChI=1S/C13H13N5O2/c1-16-11-10(12(19)17(2)13(16)20)18(8-15-11)7-9-5-3-4-6-14-9/h3-6,8H,7H2,1-2H3
InChIKey NNKLCVWXYDDDDG-UHFFFAOYSA-N
Molecular Weight 271.280 g/mol
SMILES c12c(C(N(C)C(N2C)=O)=O)[n](Cc2ncccc2)cn1
SPLASH splash10-006x-9850000000-0fc6a1fd42f2f5ea965f
Wiley ID 1441620