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8-Bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID CRMcJxpGkWn
InChI InChI=1S/C15H12BrFN4O3/c1-19-12-11(13(23)20(2)15(19)24)21(14(16)18-12)7-10(22)8-3-5-9(17)6-4-8/h3-6H,7H2,1-2H3
InChIKey NRJXYTRLRXVHCC-UHFFFAOYSA-N
Mol Weight 395.19 g/mol
Molecular Formula C15H12BrFN4O3
Exact Mass 394.007681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EblU3kEbl5
Name 8-Bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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Formula C15H12BrFN4O3
InChI InChI=1S/C15H12BrFN4O3/c1-19-12-11(13(23)20(2)15(19)24)21(14(16)18-12)7-10(22)8-3-5-9(17)6-4-8/h3-6H,7H2,1-2H3
InChIKey NRJXYTRLRXVHCC-UHFFFAOYSA-N
Molecular Weight 395.188 g/mol
SMILES CN1C(N(C(c2c1nc([n]2CC(=O)c1ccc(cc1)F)Br)=O)C)=O
SPLASH splash10-00di-6905000000-597b14e2c66ff55603e1
Synonyms 8-Bromanyl-7-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione 8-Bromo-7-[2-(4-fluorophenyl)-2-keto-ethyl]-1,3-dimethyl-xanthine 8-Bromo-7-[2-(4-fluorophenyl)-2-oxo-ethyl]-1,3-dimethyl-purine-2,6-dione Purine-2,6-dione, 8-bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-
Wiley ID 1445924