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1-[2-(3,4-dichlorophenyl)-2-hydroxyethyl]-3-heptyl-1,3-dihydro-2H-benzimidazol-2-iminium chloride
SpectraBase Compound ID 9HG2nJgQvp6
InChI InChI=1S/C22H27Cl2N3O.ClH/c1-2-3-4-5-8-13-26-19-9-6-7-10-20(19)27(22(26)25)15-21(28)16-11-12-17(23)18(24)14-16;/h6-7,9-12,14,21,25,28H,2-5,8,13,15H2,1H3;1H
InChIKey GLILHYDCUCFOIV-UHFFFAOYSA-N
Mol Weight 456.85 g/mol
Molecular Formula C22H28Cl3N3O
Exact Mass 455.129796 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J6bclve0DX3
Name 1-[2-(3,4-dichlorophenyl)-2-hydroxyethyl]-3-heptyl-1,3-dihydro-2H-benzimidazol-2-iminium chloride
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/C22H27Cl2N3O.ClH/c1-2-3-4-5-8-13-26-19-9-6-7-10-20(19)27(22(26)25)15-21(28)16-11-12-17(23)18(24)14-16;/h6-7,9-12,14,21,25,28H,2-5,8,13,15H2,1H3;1H
InChIKey GLILHYDCUCFOIV-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1648
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: 701016RRVA-664; Labnumber: 701016RRVA-664; VK_ID: VK-001649
Temperature 313 °C