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7-(2-Methoxyphenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID HY2x3dZBQ75
InChI InChI=1S/C17H14F6N4O3/c1-26-12-10(13(28)27(2)14(26)29)15(16(18,19)20,17(21,22)23)25-11(24-12)8-6-4-5-7-9(8)30-3/h4-7H,1-3H3,(H,24,25)
InChIKey LTOOKNDKOQKSKB-UHFFFAOYSA-N
Mol Weight 436.31 g/mol
Molecular Formula C17H14F6N4O3
Exact Mass 436.097009 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KX9JHPYIxql
Name 7-(2-Methoxyphenyl)-1,3-dimethyl-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 C17H14F6N4O3
InChI InChI=1S/C17H14F6N4O3/c1-26-12-10(13(28)27(2)14(26)29)15(16(18,19)20,17(21,22)23)25-11(24-12)8-6-4-5-7-9(8)30-3/h4-7H,1-3H3,(H,24,25)
InChIKey LTOOKNDKOQKSKB-UHFFFAOYSA-N
Molecular Weight 436.314 g/mol
SMILES N1C2=C(C(N=C1c1c(OC)cccc1)(C(F)(F)F)C(F)(F)F)C(N(C(N2C)=O)C)=O
SPLASH splash10-0159-3906000000-ec8ac8dfa8328ec498bf
Synonyms 7-(2-Methoxyphenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(2-Methoxyphenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone
Wiley ID 1443128