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1,2-benzenedicarbonitrile, 4,5-bis[4-(triphenylmethyl)phenoxy]-
SpectraBase Compound ID 4ejk1dT1uwM
InChI InChI=1S/C58H40N2O2/c59-41-43-39-55(61-53-35-31-51(32-36-53)57(45-19-7-1-8-20-45,46-21-9-2-10-22-46)47-23-11-3-12-24-47)56(40-44(43)42-60)62-54-37-33-52(34-38-54)58(48-25-13-4-14-26-48,49-27-15-5-16-28-49)50-29-17-6-18-30-50/h1-40H
InChIKey IMTKHVIXDLPQJL-UHFFFAOYSA-N
Mol Weight 797.0 g/mol
Molecular Formula C58H40N2O2
Exact Mass 796.308979 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J3Or0XZtbn
Name 1,2-benzenedicarbonitrile, 4,5-bis[4-(triphenylmethyl)phenoxy]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 796.308978534 u
Formula C58H40N2O2
InChI InChI=1S/C58H40N2O2/c59-41-43-39-55(61-53-35-31-51(32-36-53)57(45-19-7-1-8-20-45,46-21-9-2-10-22-46)47-23-11-3-12-24-47)56(40-44(43)42-60)62-54-37-33-52(34-38-54)58(48-25-13-4-14-26-48,49-27-15-5-16-28-49)50-29-17-6-18-30-50/h1-40H
InChIKey IMTKHVIXDLPQJL-UHFFFAOYSA-N
Molecular Weight 796.970 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11313
Solvent DMSO-d6
Source Vendor ID: NMR/10261263; Lab Info: AI; Lab Number: AI-S001338
Temperature 23.85 °C