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4-[(E)-(benzoylhydrazono)methyl]-2-methoxyphenyl 4-methylbenzenesulfonate

View entire compound with spectra: 2 NMR

4-[(E)-(benzoylhydrazono)methyl]-2-methoxyphenyl 4-methylbenzenesulfonate
SpectraBase Compound ID LEqvGaI2NFy
InChI InChI=1S/C22H20N2O5S/c1-16-8-11-19(12-9-16)30(26,27)29-20-13-10-17(14-21(20)28-2)15-23-24-22(25)18-6-4-3-5-7-18/h3-15H,1-2H3,(H,24,25)/b23-15+
InChIKey VLGIOAYNYNESKU-HZHRSRAPSA-N
Mol Weight 424.47 g/mol
Molecular Formula C22H20N2O5S
Exact Mass 424.109293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVa9fdS34Uc
Name 4-[(E)-(Benzoylhydrazono)methyl]-2-methoxyphenyl 4-methylbenzenesulfonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.109292921 u
Formula C22H20N2O5S
InChI InChI=1S/C22H20N2O5S/c1-16-8-11-19(12-9-16)30(26,27)29-20-13-10-17(14-21(20)28-2)15-23-24-22(25)18-6-4-3-5-7-18/h3-15H,1-2H3,(H,24,25)/b23-15+
InChIKey VLGIOAYNYNESKU-HZHRSRAPSA-N
Molecular Weight 424.471 g/mol
SMILES N(\N=C\C1=CC(=C(OS(C2=CC=C(C=C2)C)(=O)=O)C=C1)OC)C(=O)C1=CC=CC=C1