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1-allyl-3-[2-(3,4-dichlorophenyl)-2-hydroxyethyl]-1,3-dihydro-2H-benzimidazol-2-iminium chloride
SpectraBase Compound ID JqCXqBAFuUX
InChI InChI=1S/C18H17Cl2N3O.ClH/c1-2-9-22-15-5-3-4-6-16(15)23(18(22)21)11-17(24)12-7-8-13(19)14(20)10-12;/h2-8,10,17,21,24H,1,9,11H2;1H
InChIKey GRJUPJKQQVQMLL-UHFFFAOYSA-N
Mol Weight 398.72 g/mol
Molecular Formula C18H18Cl3N3O
Exact Mass 397.051545 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HhylbL3clo7
Name 1-allyl-3-[2-(3,4-dichlorophenyl)-2-hydroxyethyl]-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/C18H17Cl2N3O.ClH/c1-2-9-22-15-5-3-4-6-16(15)23(18(22)21)11-17(24)12-7-8-13(19)14(20)10-12;/h2-8,10,17,21,24H,1,9,11H2;1H
InChIKey GRJUPJKQQVQMLL-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1649
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: 701017RRVA-666; Labnumber: 701017RRVA-666; VK_ID: VK-001650
Temperature 313 °C