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(Z)-2-(benzoylamino)-3-[3-methyl-5-phenyl-1-([1,2,4]triazolo[3,4-f]pyridazin-6-yl)pyrazol-4-yl]acrylic acid
SpectraBase Compound ID Ba7YWRgyM0d
InChI InChI=1S/C25H19N7O3/c1-16-19(14-20(25(34)35)27-24(33)18-10-6-3-7-11-18)23(17-8-4-2-5-9-17)32(29-16)22-13-12-21-28-26-15-31(21)30-22/h2-15H,1H3,(H,27,33)(H,34,35)/b20-14-
InChIKey JYZCRKXKNZLMPH-ZHZULCJRSA-N
Mol Weight 465.47 g/mol
Molecular Formula C25H19N7O3
Exact Mass 465.154937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XFz3DOvYAo
Name (Z)-2-(benzoylamino)-3-[3-methyl-5-phenyl-1-([1,2,4]triazolo[3,4-f]pyridazin-6-yl)pyrazol-4-yl]acrylic acid
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H19N7O3
InChI InChI=1S/C25H19N7O3/c1-16-19(14-20(25(34)35)27-24(33)18-10-6-3-7-11-18)23(17-8-4-2-5-9-17)32(29-16)22-13-12-21-28-26-15-31(21)30-22/h2-15H,1H3,(H,27,33)(H,34,35)/b20-14-
InChIKey JYZCRKXKNZLMPH-ZHZULCJRSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 465.471 g/mol
Source File Reference MHKO18502