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4-Trifluoromethyl-6,8-dimethyl-3-(p-nitrophenyl)-5,6,7,8-tetrahydropyrimido[4,5-c]pyridazine-5,7-dione
SpectraBase Compound ID 564C7UMS58q
InChI InChI=1S/C15H10F3N5O4/c1-21-12-9(13(24)22(2)14(21)25)10(15(16,17)18)11(19-20-12)7-3-5-8(6-4-7)23(26)27/h3-6H,1-2H3
InChIKey WJIDGMDEUKEEQW-UHFFFAOYSA-N
Mol Weight 381.27 g/mol
Molecular Formula C15H10F3N5O4
Exact Mass 381.068488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14E4IwE0UDW
Name 4-Trifluoromethyl-6,8-dimethyl-3-(p-nitrophenyl)-5,6,7,8-tetrahydropyrimido[4,5-c]pyridazine-5,7-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10F3N5O4
InChI InChI=1S/C15H10F3N5O4/c1-21-12-9(13(24)22(2)14(21)25)10(15(16,17)18)11(19-20-12)7-3-5-8(6-4-7)23(26)27/h3-6H,1-2H3
InChIKey WJIDGMDEUKEEQW-UHFFFAOYSA-N
Molecular Weight 381.271 g/mol
SMILES c12c(c(c(nn2)-c2ccc(cc2)N(=O)=O)C(F)(F)F)C(N(C(N1C)=O)C)=O
SPLASH splash10-0f89-0096000000-12acec0343a01b39fea2
Source of Spectrum H1-68-1880-4
Synonyms 6,8-Dimethyl-3-(4-nitrophenyl)-4-(trifluoromethyl)pyrimido[4,5-c]pyridazine-5,7(6H,8H)-dione
Wiley ID 1593616