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3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[2-(diethylamino)ethyl]-1H-benzimidazol-2-yl}benzamide
SpectraBase Compound ID 4MnEEAcqoo0
InChI InChI=1S/C24H26BrN7O3/c1-3-29(4-2)12-13-31-21-11-6-5-10-20(21)26-24(31)27-23(33)18-9-7-8-17(14-18)15-30-16-19(25)22(28-30)32(34)35/h5-11,14,16H,3-4,12-13,15H2,1-2H3,(H,26,27,33)
InChIKey PPUWVBMKJHEGRY-UHFFFAOYSA-N
Mol Weight 540.42 g/mol
Molecular Formula C24H26BrN7O3
Exact Mass 539.128051 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4h0ivyF0lmF
Name 3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[2-(diethylamino)ethyl]-1H-benzimidazol-2-yl}benzamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H26BrN7O3/c1-3-29(4-2)12-13-31-21-11-6-5-10-20(21)26-24(31)27-23(33)18-9-7-8-17(14-18)15-30-16-19(25)22(28-30)32(34)35/h5-11,14,16H,3-4,12-13,15H2,1-2H3,(H,26,27,33)
InChIKey PPUWVBMKJHEGRY-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20160
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9158752; UBI_ID: UBI-020164
Temperature 313 °C