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7-Ethyl-1,3-dimethyl-8-phenylxanthine
SpectraBase Compound ID 9uA1AQY5k2Y
InChI InChI=1S/C15H16N4O2/c1-4-19-11-13(17(2)15(21)18(3)14(11)20)16-12(19)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChIKey XOUKJLPIODUYKG-UHFFFAOYSA-N
Mol Weight 284.32 g/mol
Molecular Formula C15H16N4O2
Exact Mass 284.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID amibjL9c6b
Name 7-Ethyl-1,3-dimethyl-8-phenylxanthine
Alternate Name(s) 7-Ethyl-1,3-dimethyl-8-phenyl-1H-purine-2,6(3H,7H)-dione 7-Ethyl-1,3-dimethyl-8-phenylpurine-2,6-dione 7-Ethyl-1,3-dimethyl-8-phenyl-purine-2,6-dione
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Formula C15H16N4O2
InChI InChI=1S/C15H16N4O2/c1-4-19-11-13(17(2)15(21)18(3)14(11)20)16-12(19)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChIKey XOUKJLPIODUYKG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200065s
Molecular Weight 284.319 g/mol
SMILES C1(N(C(c2[n](c(nc2N1C)-c1ccccc1)CC)=O)C)=O
SPLASH splash10-001i-0090000000-7bb9ceb43fd57c40183c
Source of Spectrum A1-13-1378/SMS12-3b
Wiley ID 1752853