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3-benzyl-1-[2-oxo-2-(4-propionylanilino)ethyl]-3H-benzimidazol-1-ium iodide
SpectraBase Compound ID 2SLLV5IQyiH
InChI InChI=1S/C25H23N3O2.HI/c1-2-24(29)20-12-14-21(15-13-20)26-25(30)17-28-18-27(16-19-8-4-3-5-9-19)22-10-6-7-11-23(22)28;/h3-15,18H,2,16-17H2,1H3;1H
InChIKey MXVXHNLENHMRJC-UHFFFAOYSA-N
Mol Weight 525.39 g/mol
Molecular Formula C25H24IN3O2
Exact Mass 525.091322 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8pZK5jEzPaW
Name 3-benzyl-1-[2-oxo-2-(4-propionylanilino)ethyl]-3H-benzimidazol-1-ium iodide
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/C25H23N3O2.HI/c1-2-24(29)20-12-14-21(15-13-20)26-25(30)17-28-18-27(16-19-8-4-3-5-9-19)22-10-6-7-11-23(22)28;/h3-15,18H,2,16-17H2,1H3;1H
InChIKey MXVXHNLENHMRJC-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16177
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: 987/00003323; Labnumber: 987/00003323218840; VK_ID: VK-016182
Temperature 308 °C