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1-Benzyl-7-(2-furyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 8hAp8zVir2T
InChI InChI=1S/C19H12F6N4O3/c20-18(21,22)17(19(23,24)25)12-14(26-13(28-17)11-7-4-8-32-11)29(16(31)27-15(12)30)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,26,28)(H,27,30,31)
InChIKey INGIGKYMXPJJPC-UHFFFAOYSA-N
Mol Weight 458.32 g/mol
Molecular Formula C19H12F6N4O3
Exact Mass 458.081359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdUqvABhUdO
Name 1-Benzyl-7-(2-furyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Alternate Name(s) 1-Benzyl-7-(2-furyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1-Benzyl-7-(2-furyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone 1-Benzyl-7-(furan-2-yl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(2-furanyl)-1-(phenylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(furan-2-yl)-1-(phenylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
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Formula C19H12F6N4O3
InChI InChI=1S/C19H12F6N4O3/c20-18(21,22)17(19(23,24)25)12-14(26-13(28-17)11-7-4-8-32-11)29(16(31)27-15(12)30)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,26,28)(H,27,30,31)
InChIKey INGIGKYMXPJJPC-UHFFFAOYSA-N
Molecular Weight 458.320 g/mol
SMILES N1C(C=2C(N=C(NC2N(Cc2ccccc2)C1=O)c1occc1)(C(F)(F)F)C(F)(F)F)=O
SPLASH splash10-0006-9101000000-fb726c0e7e542405425c
Wiley ID 1442465