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2-(4-amino-2-chlorophenoxy)-5-chlorobenzenesulfonic acid, sodium salt

View entire compound with spectra: 3 NMR, and 1 FTIR

2-(4-amino-2-chlorophenoxy)-5-chlorobenzenesulfonic acid, sodium salt
SpectraBase Compound ID 2qomuqID4R
InChI InChI=1S/C12H9Cl2NO4S.Na/c13-7-1-3-11(12(5-7)20(16,17)18)19-10-4-2-8(15)6-9(10)14;/h1-6H,15H2,(H,16,17,18);/q;+1/p-1
InChIKey YDFVURYYUXIMNQ-UHFFFAOYSA-M
Mol Weight 356.15 g/mol
Molecular Formula C12H8Cl2NNaO4S
Exact Mass 354.944879 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3aL2ysv5TG4
Name sodium 2-(4-amino-2-chlorophenoxy)-5-chlorobenzenesulfonate
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/C12H9Cl2NO4S.Na/c13-7-1-3-11(12(5-7)20(16,17)18)19-10-4-2-8(15)6-9(10)14;/h1-6H,15H2,(H,16,17,18);/q;+1/p-1
InChIKey YDFVURYYUXIMNQ-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16980
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: 987/00004752; Labnumber: 987/00004752218858; VK_ID: VK-016985
Temperature 318 °C