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7-(2-furanyl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
SpectraBase Compound ID JjNPhjXASZp
InChI InChI=1S/C18H10F6N4O3/c19-17(20,21)16(18(22,23)24)11-13(25-12(27-16)10-7-4-8-31-10)28(15(30)26-14(11)29)9-5-2-1-3-6-9/h1-8H,(H,25,27)(H,26,29,30)
InChIKey PLIFXJZWLKVKLJ-UHFFFAOYSA-N
Mol Weight 444.29 g/mol
Molecular Formula C18H10F6N4O3
Exact Mass 444.065709 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FfjumXBckS
Name 7-(2-furanyl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
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Formula C18H10F6N4O3
InChI InChI=1S/C18H10F6N4O3/c19-17(20,21)16(18(22,23)24)11-13(25-12(27-16)10-7-4-8-31-10)28(15(30)26-14(11)29)9-5-2-1-3-6-9/h1-8H,(H,25,27)(H,26,29,30)
InChIKey PLIFXJZWLKVKLJ-UHFFFAOYSA-N
Molecular Weight 444.293 g/mol
SMILES N1C(N(C2=C(C1=O)C(N=C(N2)c1occc1)(C(F)(F)F)C(F)(F)F)c1ccccc1)=O
SPLASH splash10-004i-9423000000-301fd14532d41513408f
Synonyms 7-(2-furyl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(2-furyl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone 7-(furan-2-yl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
Wiley ID 1443205