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7-(2-Fluorophenyl)-1-phenyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID ExfShMs2wo9
InChI InChI=1S/C20H11F7N4O2/c21-12-9-5-4-8-11(12)14-28-15-13(18(30-14,19(22,23)24)20(25,26)27)16(32)29-17(33)31(15)10-6-2-1-3-7-10/h1-9H,(H,28,30)(H,29,32,33)
InChIKey NZBKCDSURFLEBY-UHFFFAOYSA-N
Mol Weight 472.32 g/mol
Molecular Formula C20H11F7N4O2
Exact Mass 472.077023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5OVur5Md34r
Name 7-(2-Fluorophenyl)-1-phenyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Alternate Name(s) 7-(2-fluorophenyl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(2-fluorophenyl)-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone
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Formula C20H11F7N4O2
InChI InChI=1S/C20H11F7N4O2/c21-12-9-5-4-8-11(12)14-28-15-13(18(30-14,19(22,23)24)20(25,26)27)16(32)29-17(33)31(15)10-6-2-1-3-7-10/h1-9H,(H,28,30)(H,29,32,33)
InChIKey NZBKCDSURFLEBY-UHFFFAOYSA-N
Molecular Weight 472.323 g/mol
SMILES N1C(N(C2=C(C1=O)C(N=C(N2)c1c(cccc1)F)(C(F)(F)F)C(F)(F)F)c1ccccc1)=O
SPLASH splash10-0w29-9750500000-c0b8d5f5ccc6b4f00228
Wiley ID 1443656