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1,7-Dibenzyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID BLuB0rfWmIc
InChI InChI=1S/C22H16F6N4O2/c23-21(24,25)20(22(26,27)28)16-17(29-15(31-20)11-13-7-3-1-4-8-13)32(19(34)30-18(16)33)12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,29,31)(H,30,33,34)
InChIKey LJKOQXWRMQXRJT-UHFFFAOYSA-N
Mol Weight 482.39 g/mol
Molecular Formula C22H16F6N4O2
Exact Mass 482.117745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwkxfP4Fxb2
Name 1,7-Dibenzyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16F6N4O2
InChI InChI=1S/C22H16F6N4O2/c23-21(24,25)20(22(26,27)28)16-17(29-15(31-20)11-13-7-3-1-4-8-13)32(19(34)30-18(16)33)12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,29,31)(H,30,33,34)
InChIKey LJKOQXWRMQXRJT-UHFFFAOYSA-N
Molecular Weight 482.386 g/mol
SMILES N1C(C=2C(N=C(NC2N(Cc2ccccc2)C1=O)Cc1ccccc1)(C(F)(F)F)C(F)(F)F)=O
SPLASH splash10-0006-9200300000-2d021753f97bd4714fc8
Synonyms 1,7-bis(phenylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1,7-Dibenzyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1,7-Dibenzyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone
Wiley ID 1442308