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7-Benzyl-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 6imHQoCQx5p
InChI InChI=1S/C17H14F6N4O2/c1-26-12-11(13(28)27(2)14(26)29)15(16(18,19)20,17(21,22)23)25-10(24-12)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,24,25)
InChIKey YAOKLVBXPGFCKD-UHFFFAOYSA-N
Mol Weight 420.32 g/mol
Molecular Formula C17H14F6N4O2
Exact Mass 420.102095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYTi7iOIKUr
Name 7-Benzyl-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Alternate Name(s) 1,3-Dimethyl-7-(phenylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-Benzyl-1,3-dimethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-Benzyl-1,3-dimethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone
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Formula C17H14F6N4O2
InChI InChI=1S/C17H14F6N4O2/c1-26-12-11(13(28)27(2)14(26)29)15(16(18,19)20,17(21,22)23)25-10(24-12)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,24,25)
InChIKey YAOKLVBXPGFCKD-UHFFFAOYSA-N
Molecular Weight 420.315 g/mol
SMILES N1C(=NC(C2=C1N(C(N(C2=O)C)=O)C)(C(F)(F)F)C(F)(F)F)Cc1ccccc1
SPLASH splash10-0ue9-7916000000-d1d87063fa319dee1db4
Wiley ID 1443127