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4-Trifluoromethyl-4-hydroxy-6,8-dimethyl-3-(4-methylphenyl)-1,4,5,6,7,8-hexahydropyrimido[4,5-c]pyridazine-5,7-dione
SpectraBase Compound ID Gsravcp08oK
InChI InChI=1S/C16H15F3N4O3/c1-8-4-6-9(7-5-8)11-15(26,16(17,18)19)10-12(21-20-11)22(2)14(25)23(3)13(10)24/h4-7,21,26H,1-3H3
InChIKey YNVXKMDVUZQBGA-UHFFFAOYSA-N
Mol Weight 368.32 g/mol
Molecular Formula C16H15F3N4O3
Exact Mass 368.109625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ma1xlIwuyK
Name 4-Trifluoromethyl-4-hydroxy-6,8-dimethyl-3-(4-methylphenyl)-1,4,5,6,7,8-hexahydropyrimido[4,5-c]pyridazine-5,7-dione
Alternate Name(s) 4-Hydroxy-6,8-dimethyl-3-(4-methylphenyl)-4-(trifluoromethyl)-4,8-dihydropyrimido[4,5-c]pyridazine-5,7(1H,6H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15F3N4O3
InChI InChI=1S/C16H15F3N4O3/c1-8-4-6-9(7-5-8)11-15(26,16(17,18)19)10-12(21-20-11)22(2)14(25)23(3)13(10)24/h4-7,21,26H,1-3H3
InChIKey YNVXKMDVUZQBGA-UHFFFAOYSA-N
Molecular Weight 368.316 g/mol
SMILES N1N=C(C(C2=C1N(C(N(C2=O)C)=O)C)(O)C(F)(F)F)c1ccc(cc1)C
SPLASH splash10-0f6w-0093000000-3ac17a17b615878973d0
Source of Spectrum H1-68-1879-3
Wiley ID 1593621