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N-{4-[(2-chlorobenzyl)oxy]-3-ethoxy-5-iodobenzyl}-1-hydroxy-2-methyl-2-propanaminium chloride
SpectraBase Compound ID CAj7RWB2A5b
InChI InChI=1S/C20H25ClINO3.ClH/c1-4-25-18-10-14(11-23-20(2,3)13-24)9-17(22)19(18)26-12-15-7-5-6-8-16(15)21;/h5-10,23-24H,4,11-13H2,1-3H3;1H
InChIKey KAZXFNSIGQAENL-UHFFFAOYSA-N
Mol Weight 526.24 g/mol
Molecular Formula C20H26Cl2INO3
Exact Mass 525.033444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Eit9AzwAmxG
Name N-{4-[(2-chlorobenzyl)oxy]-3-ethoxy-5-iodobenzyl}-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/C20H25ClINO3.ClH/c1-4-25-18-10-14(11-23-20(2,3)13-24)9-17(22)19(18)26-12-15-7-5-6-8-16(15)21;/h5-10,23-24H,4,11-13H2,1-3H3;1H
InChIKey KAZXFNSIGQAENL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31666
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: 1843182; SBI_ID: SBI-031670
Temperature 318 °C