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1-(4-chlorobenzyl)-N'-((E)-{2-[(3-methoxybenzyl)oxy]phenyl}methylidene)-1H-pyrazole-3-carbohydrazide
SpectraBase Compound ID 2SeRFxt5N0L
InChI InChI=1S/C26H23ClN4O3/c1-33-23-7-4-5-20(15-23)18-34-25-8-3-2-6-21(25)16-28-29-26(32)24-13-14-31(30-24)17-19-9-11-22(27)12-10-19/h2-16H,17-18H2,1H3,(H,29,32)/b28-16+
InChIKey FOCWUMXMMVNHDL-LQKURTRISA-N
Mol Weight 474.95 g/mol
Molecular Formula C26H23ClN4O3
Exact Mass 474.145868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HYu3KUpf58a
Name 1-(4-Chlorobenzyl)-N'-((E)-{2-[(3-methoxybenzyl)oxy]phenyl}methylidene)-1H-pyrazole-3-carbohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.145868314 u
Formula C26H23ClN4O3
InChI InChI=1S/C26H23ClN4O3/c1-33-23-7-4-5-20(15-23)18-34-25-8-3-2-6-21(25)16-28-29-26(32)24-13-14-31(30-24)17-19-9-11-22(27)12-10-19/h2-16H,17-18H2,1H3,(H,29,32)/b28-16+
InChIKey FOCWUMXMMVNHDL-LQKURTRISA-N
Molecular Weight 474.948 g/mol
SMILES N(\N=C\C1=C(OCC=2C=C(OC)C=CC2)C=CC=C1)C(C1=NN(CC=2C=CC(Cl)=CC2)C=C1)=O