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1-(4-fluorophenyl)-7-(4-methylphenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 1GcBTOgnRm8
InChI InChI=1S/C21H13F7N4O2/c1-10-2-4-11(5-3-10)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)13-8-6-12(22)7-9-13/h2-9H,1H3,(H,29,31)(H,30,33,34)
InChIKey UVWNKIZDVOMCKS-UHFFFAOYSA-N
Mol Weight 486.35 g/mol
Molecular Formula C21H13F7N4O2
Exact Mass 486.092673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IelQ5XbPCaw
Name 1-(4-Fluoro-phenyl)-7-p-tolyl-5,5-bis-trifluoromethyl-5,8-dihydro-1H-pyrimido[4,5-d]pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13F7N4O2
InChI InChI=1S/C21H13F7N4O2/c1-10-2-4-11(5-3-10)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)13-8-6-12(22)7-9-13/h2-9H,1H3,(H,29,31)(H,30,33,34)
InChIKey UVWNKIZDVOMCKS-UHFFFAOYSA-N
Molecular Weight 486.350 g/mol
SMILES N1C(N(C2=C(C1=O)C(N=C(N2)c1ccc(cc1)C)(C(F)(F)F)C(F)(F)F)c1ccc(cc1)F)=O
SPLASH splash10-02t9-9851600000-120c0c6875e4d76d654a
Synonyms 1-(4-Fluorophenyl)-7-(4-methylphenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione 1-(4-fluorophenyl)-7-(4-methylphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1-(4-fluorophenyl)-7-(p-tolyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1-(4-fluorophenyl)-7-(p-tolyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone
Wiley ID 1443643