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4-[3-({3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzyl}ammonio)propyl]morpholin-4-ium dichloride
SpectraBase Compound ID ABa8oHurczB
InChI InChI=1S/C23H30BrClN2O3.2ClH/c1-2-29-22-15-18(16-26-8-5-9-27-10-12-28-13-11-27)14-20(24)23(22)30-17-19-6-3-4-7-21(19)25;;/h3-4,6-7,14-15,26H,2,5,8-13,16-17H2,1H3;2*1H
InChIKey CHYFCJRRCLGBKZ-UHFFFAOYSA-N
Mol Weight 570.78 g/mol
Molecular Formula C23H32BrCl3N2O3
Exact Mass 568.066189 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dr2L0fVlSQ8
Name 4-[3-({3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzyl}ammonio)propyl]morpholin-4-ium dichloride
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/C23H30BrClN2O3.2ClH/c1-2-29-22-15-18(16-26-8-5-9-27-10-12-28-13-11-27)14-20(24)23(22)30-17-19-6-3-4-7-21(19)25;;/h3-4,6-7,14-15,26H,2,5,8-13,16-17H2,1H3;2*1H
InChIKey CHYFCJRRCLGBKZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31555
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: 1843011; SBI_ID: SBI-031559
Temperature 308 °C