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5-Amino-1-(6-phenyl-pyridazin-3-yl)-1H-pyrazole-4-carboxylic acid benzylidene-hydrazide
SpectraBase Compound ID YOg8bZX4NB
InChI InChI=1S/C21H17N7O/c22-20-17(21(29)27-23-13-15-7-3-1-4-8-15)14-24-28(20)19-12-11-18(25-26-19)16-9-5-2-6-10-16/h1-14H,22H2,(H,27,29)/b23-13+
InChIKey MALRXSYDCFVJND-YDZHTSKRSA-N
Mol Weight 383.42 g/mol
Molecular Formula C21H17N7O
Exact Mass 383.149458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HBuOWpxTQnk
Name 5-Amino-1-(6-phenyl-pyridazin-3-yl)-1H-pyrazole-4-carboxylic acid benzylidene-hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.149458194 u
Formula C21H17N7O
InChI InChI=1S/C21H17N7O/c22-20-17(21(29)27-23-13-15-7-3-1-4-8-15)14-24-28(20)19-12-11-18(25-26-19)16-9-5-2-6-10-16/h1-14H,22H2,(H,27,29)/b23-13+
InChIKey MALRXSYDCFVJND-YDZHTSKRSA-N
Molecular Weight 383.415 g/mol
SMILES C=1(N(N=CC1C(N\N=C\C=1C=CC=CC1)=O)C=1N=NC(=CC1)C1=CC=CC=C1)N