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benzamide, 2,4-dichloro-N-[(Z)-2-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-[[(2-pyridinylmethyl)amino]carbonyl]ethenyl]-
SpectraBase Compound ID JEMsPfFP8CI
InChI InChI=1S/C31H22Cl3N5O2/c32-22-11-9-20(10-12-22)29-21(19-39(38-29)25-7-2-1-3-8-25)16-28(31(41)36-18-24-6-4-5-15-35-24)37-30(40)26-14-13-23(33)17-27(26)34/h1-17,19H,18H2,(H,36,41)(H,37,40)/b28-16-
InChIKey XRSZCNHXBAGBNH-NTFVMDSBSA-N
Mol Weight 602.91 g/mol
Molecular Formula C31H22Cl3N5O2
Exact Mass 601.083908 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EOvIRCpBvZq
Name benzamide, 2,4-dichloro-N-[(Z)-2-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-[[(2-pyridinylmethyl)amino]carbonyl]ethenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 601.083908066 u
Formula C31H22Cl3N5O2
InChI InChI=1S/C31H22Cl3N5O2/c32-22-11-9-20(10-12-22)29-21(19-39(38-29)25-7-2-1-3-8-25)16-28(31(41)36-18-24-6-4-5-15-35-24)37-30(40)26-14-13-23(33)17-27(26)34/h1-17,19H,18H2,(H,36,41)(H,37,40)/b28-16-
InChIKey XRSZCNHXBAGBNH-NTFVMDSBSA-N
Molecular Weight 602.909 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1561
Solvent DMSO-d6
Source Vendor ID: ZI/8131387; Lab Info: VIN; Lab Number: VIN-km00306