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1-[2-(3,4-dichlorophenyl)-2-oxoethyl]-3-(4-methylbenzyl)-1,3-dihydro-2H-benzimidazol-2-iminium bromide
SpectraBase Compound ID COjtBC3wIuA
InChI InChI=1S/C23H19Cl2N3O.BrH/c1-15-6-8-16(9-7-15)13-27-20-4-2-3-5-21(20)28(23(27)26)14-22(29)17-10-11-18(24)19(25)12-17;/h2-12,26H,13-14H2,1H3;1H
InChIKey QLUCPTCRJCKPDW-UHFFFAOYSA-N
Mol Weight 505.24 g/mol
Molecular Formula C23H20BrCl2N3O
Exact Mass 503.016681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2FDBH96rXmL
Name 1-[2-(3,4-dichlorophenyl)-2-oxoethyl]-3-(4-methylbenzyl)-1,3-dihydro-2H-benzimidazol-2-iminium bromide
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/C23H19Cl2N3O.BrH/c1-15-6-8-16(9-7-15)13-27-20-4-2-3-5-21(20)28(23(27)26)14-22(29)17-10-11-18(24)19(25)12-17;/h2-12,26H,13-14H2,1H3;1H
InChIKey QLUCPTCRJCKPDW-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1662
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: 701033RRVA-686; Labnumber: 701033RRVA-686; VK_ID: VK-001663
Temperature 313 °C