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N-(3-ethoxy-5-iodo-4-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}benzyl)-1-hydroxy-2-methyl-2-propanaminium chloride
SpectraBase Compound ID b5oFVg5gZD
InChI InChI=1S/C23H31IN2O4.ClH/c1-4-29-20-13-18(14-26-23(2,3)16-27)12-19(24)22(20)30-15-21(28)25-11-10-17-8-6-5-7-9-17;/h5-9,12-13,26-27H,4,10-11,14-16H2,1-3H3,(H,25,28);1H
InChIKey RJEJIOYTBWEJQM-UHFFFAOYSA-N
Mol Weight 562.9 g/mol
Molecular Formula C23H32ClIN2O4
Exact Mass 562.10953 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EMuLSmSmrJs
Name N-(3-ethoxy-5-iodo-4-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}benzyl)-1-hydroxy-2-methyl-2-propanaminium 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/C23H31IN2O4.ClH/c1-4-29-20-13-18(14-26-23(2,3)16-27)12-19(24)22(20)30-15-21(28)25-11-10-17-8-6-5-7-9-17;/h5-9,12-13,26-27H,4,10-11,14-16H2,1-3H3,(H,25,28);1H
InChIKey RJEJIOYTBWEJQM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31976
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: 1844422; SBI_ID: SBI-031980
Temperature 318 °C