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7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 94b9Q3FwFG4
InChI InChI=1S/C20H18F6N4O2/c21-19(22,23)18(20(24,25)26)13-15(27-14(29-18)11-7-3-1-4-8-11)30(17(32)28-16(13)31)12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2,(H,27,29)(H,28,31,32)
InChIKey HQCQHLHBEFCPPN-UHFFFAOYSA-N
Mol Weight 460.38 g/mol
Molecular Formula C20H18F6N4O2
Exact Mass 460.133395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Pz02GYWYtv
Name 7-Cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18F6N4O2
InChI InChI=1S/C20H18F6N4O2/c21-19(22,23)18(20(24,25)26)13-15(27-14(29-18)11-7-3-1-4-8-11)30(17(32)28-16(13)31)12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2,(H,27,29)(H,28,31,32)
InChIKey HQCQHLHBEFCPPN-UHFFFAOYSA-N
Molecular Weight 460.380 g/mol
SMILES N1C(C=2C(N=C(NC2N(c2ccccc2)C1=O)C1CCCCC1)(C(F)(F)F)C(F)(F)F)=O
SPLASH splash10-0006-7319000000-3642ef0a2725b0d8ea19
Synonyms 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-cyclohexyl-1-phenyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone 7-Cyclohexyl-1-phenyl-5,5-bis-trifluoromethyl-5,8-dihydro-1H-pyrimido[4,5-d]pyrimidine-2,4-dione
Wiley ID 1442757