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(3,4-DICHLORO-beta-HYDROXYPHENETHYL)DIMETHYLISOPROPYLAMMONIUM IODIDE

View entire compound with spectra: 2 NMR, and 1 FTIR

(3,4-DICHLORO-beta-HYDROXYPHENETHYL)DIMETHYLISOPROPYLAMMONIUM IODIDE
SpectraBase Compound ID 6JTGkFQpjwP
InChI InChI=1S/C13H20Cl2NO.HI/c1-9(2)16(3,4)8-13(17)10-5-6-11(14)12(15)7-10;/h5-7,9,13,17H,8H2,1-4H3;1H/q+1;/p-1
InChIKey KQYFYSURCNOUBL-UHFFFAOYSA-M
Mol Weight 404.12 g/mol
Molecular Formula C13H20Cl2INO
Exact Mass 402.996665 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GGksHXsMDIS
Name N-[2-(3,4-dichlorophenyl)-2-hydroxyethyl]-N,N-dimethyl-2-propanaminium 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/C13H20Cl2NO.HI/c1-9(2)16(3,4)8-13(17)10-5-6-11(14)12(15)7-10;/h5-7,9,13,17H,8H2,1-4H3;1H/q+1;/p-1
InChIKey KQYFYSURCNOUBL-UHFFFAOYSA-M
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_14820
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: 987/00000760; Labnumber: 987/00000760218808; VK_ID: VK-014825
Temperature 308 °C