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7-(2-furanyl)-1-(4-methoxyphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
SpectraBase Compound ID ATSuGWc3Ygp
InChI InChI=1S/C19H12F6N4O4/c1-32-10-6-4-9(5-7-10)29-14-12(15(30)27-16(29)31)17(18(20,21)22,19(23,24)25)28-13(26-14)11-3-2-8-33-11/h2-8H,1H3,(H,26,28)(H,27,30,31)
InChIKey KGMUAPDKJOQHGO-UHFFFAOYSA-N
Mol Weight 474.32 g/mol
Molecular Formula C19H12F6N4O4
Exact Mass 474.076274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gv374lJ88Ax
Name 7-(2-furanyl)-1-(4-methoxyphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
Alternate Name(s) 7-(2-furyl)-1-(4-methoxyphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(2-furyl)-1-(4-methoxyphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone 7-(furan-2-yl)-1-(4-methoxyphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
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Formula C19H12F6N4O4
InChI InChI=1S/C19H12F6N4O4/c1-32-10-6-4-9(5-7-10)29-14-12(15(30)27-16(29)31)17(18(20,21)22,19(23,24)25)28-13(26-14)11-3-2-8-33-11/h2-8H,1H3,(H,26,28)(H,27,30,31)
InChIKey KGMUAPDKJOQHGO-UHFFFAOYSA-N
Molecular Weight 474.319 g/mol
SMILES N1C(N(C2=C(C1=O)C(N=C(N2)c1occc1)(C(F)(F)F)C(F)(F)F)c1ccc(cc1)OC)=O
SPLASH splash10-0a4i-9640500000-a8bcaee6462900ae01dc
Wiley ID 1443658