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2-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-hydroxy-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium bromide
SpectraBase Compound ID 2A0dUtNnyMK
InChI InChI=1S/C22H26ClN2O2.BrH/c1-2-27-20-13-11-19(12-14-20)25-21-6-4-3-5-15-24(21)16-22(25,26)17-7-9-18(23)10-8-17;/h7-14,26H,2-6,15-16H2,1H3;1H/q+1;/p-1
InChIKey VWRGDUMZAWNAIC-UHFFFAOYSA-M
Mol Weight 465.82 g/mol
Molecular Formula C22H26BrClN2O2
Exact Mass 464.086619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9pEg4omNe2n
Name 2-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-hydroxy-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium 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/C22H26ClN2O2.BrH/c1-2-27-20-13-11-19(12-14-20)25-21-6-4-3-5-15-24(21)16-22(25,26)17-7-9-18(23)10-8-17;/h7-14,26H,2-6,15-16H2,1H3;1H/q+1;/p-1
InChIKey VWRGDUMZAWNAIC-UHFFFAOYSA-M
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_8166
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: 129437; Labnumber: EX00079068; VK_ID: VK-008170
Temperature 315 °C