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4-Methoxybenzal, diphenylphosphorylacetylhydrazone (isomer mixture)

View entire compound with spectra: 2 NMR

4-Methoxybenzal, diphenylphosphorylacetylhydrazone (isomer mixture)
SpectraBase Compound ID 4oSGlzvmTiF
InChI InChI=1S/C22H21N2O3P/c1-27-19-14-12-18(13-15-19)16-23-24-22(25)17-28(26,20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-16H,17H2,1H3,(H,24,25)/b23-16+
InChIKey NFXZSQBRFNSYMJ-XQNSMLJCSA-N
Mol Weight 392.39 g/mol
Molecular Formula C22H21N2O3P
Exact Mass 392.12898 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F9Vlvbe7tMe
Name 4-Methoxybenzal, diphenylphosphorylacetylhydrazone (isomer mixture)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.128979539 u
Formula C22H21N2O3P
InChI InChI=1S/C22H21N2O3P/c1-27-19-14-12-18(13-15-19)16-23-24-22(25)17-28(26,20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-16H,17H2,1H3,(H,24,25)/b23-16+
InChIKey NFXZSQBRFNSYMJ-XQNSMLJCSA-N
Molecular Weight 392.395 g/mol
SMILES N(C(CP(=O)(c1ccccc1)c1ccccc1)=O)\N=C\c1ccc(cc1)OC