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7-(2-Chloro-4-fluoro-benzyl)-8-[4-[(3,5-dichloro-2-pyridyl)oxy]phenoxy]-1,3-dimethyl-xanthine
SpectraBase Compound ID AkdAUs8DW0X
InChI InChI=1S/C25H17Cl3FN5O4/c1-32-21-20(23(35)33(2)25(32)36)34(12-13-3-4-15(29)10-18(13)27)24(31-21)38-17-7-5-16(6-8-17)37-22-19(28)9-14(26)11-30-22/h3-11H,12H2,1-2H3
InChIKey JMNJWYACDKZRQF-UHFFFAOYSA-N
Mol Weight 576.8 g/mol
Molecular Formula C25H17Cl3FN5O4
Exact Mass 575.033015 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1fbg1XldTB
Name 7-(2-Chloro-4-fluoro-benzyl)-8-[4-[(3,5-dichloro-2-pyridyl)oxy]phenoxy]-1,3-dimethyl-xanthine
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Formula C25H17Cl3FN5O4
InChI InChI=1S/C25H17Cl3FN5O4/c1-32-21-20(23(35)33(2)25(32)36)34(12-13-3-4-15(29)10-18(13)27)24(31-21)38-17-7-5-16(6-8-17)37-22-19(28)9-14(26)11-30-22/h3-11H,12H2,1-2H3
InChIKey JMNJWYACDKZRQF-UHFFFAOYSA-N
Molecular Weight 576.799 g/mol
SMILES c12c([n](Cc3c(cc(cc3)F)Cl)c(n1)Oc1ccc(Oc3ncc(cc3Cl)Cl)cc1)C(N(C)C(N2C)=O)=O
SPLASH splash10-0006-4900000000-d8ff6701c178479745a5
Synonyms 7-[(2-chloro-4-fluoro-phenyl)methyl]-8-[4-[(3,5-dichloro-2-pyridyl)oxy]phenoxy]-1,3-dimethyl-purine-2,6-dione 7-[(2-chloro-4-fluorophenyl)methyl]-8-[4-(3,5-dichloropyridin-2-yl)oxyphenoxy]-1,3-dimethylpurine-2,6-dione 7-[(2-chloro-4-fluorophenyl)methyl]-8-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenoxy]-1,3-dimethylpurine-2,6-dione 8-[4-[3,5-bis(chloranyl)pyridin-2-yl]oxyphenoxy]-7-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-1,3-dimethyl-purine-2,6-dione
Wiley ID 1444661