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4',5-Dichloro-2-[(triphenylphosphoranylidene)amino]benzophenone

View entire compound with spectra: 2 NMR, and 1 FTIR

4',5-Dichloro-2-[(triphenylphosphoranylidene)amino]benzophenone
SpectraBase Compound ID DFtfvQ3BDJO
InChI InChI=1S/C31H22Cl2NOP/c32-24-18-16-23(17-19-24)31(35)29-22-25(33)20-21-30(29)34-36(26-10-4-1-5-11-26,27-12-6-2-7-13-27)28-14-8-3-9-15-28/h1-22H
InChIKey NGOVUBZLHKWPFB-UHFFFAOYSA-N
Mol Weight 526.4 g/mol
Molecular Formula C31H22Cl2NOP
Exact Mass 525.081607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9VYBI38ulUm
Name 4',5-Dichloro-2-[(triphenylphosphoranylidene)amino]benzophenone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 525.081606729 u
Formula C31H22Cl2NOP
InChI InChI=1S/C31H22Cl2NOP/c32-24-18-16-23(17-19-24)31(35)29-22-25(33)20-21-30(29)34-36(26-10-4-1-5-11-26,27-12-6-2-7-13-27)28-14-8-3-9-15-28/h1-22H
InChIKey NGOVUBZLHKWPFB-UHFFFAOYSA-N
Molecular Weight 526.403 g/mol
SMILES C=1C(=CC=C(C1)Cl)C(C=1C=C(C=CC1N=P(C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1)Cl)=O