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4-(2,4-dichlorophenoxy)metanilic acid, sodium salt

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

4-(2,4-dichlorophenoxy)metanilic acid, sodium salt
SpectraBase Compound ID 3T75eJr7J9w
InChI InChI=1S/C12H9Cl2NO4S.Na/c13-7-1-3-11(9(14)5-7)19-12-4-2-8(6-10(12)15)20(16,17)18;/h1-6H,15H2,(H,16,17,18);/q;+1/p-1
InChIKey KZUGEHLCMOQDLG-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 KjWKVlysDDy
Name sodium 3-amino-4-(2,4-dichlorophenoxy)benzenesulfonate
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(9(14)5-7)19-12-4-2-8(6-10(12)15)20(16,17)18;/h1-6H,15H2,(H,16,17,18);/q;+1/p-1
InChIKey KZUGEHLCMOQDLG-UHFFFAOYSA-M
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16926
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: 987/00004650; Labnumber: 987/00004650218856; VK_ID: VK-016931
Temperature 305 °C