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4-{[(carboxymethyl)amino]sulfonyl}benzoic acid

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4-{[(carboxymethyl)amino]sulfonyl}benzoic acid
SpectraBase Compound ID 5kRpZ0mzTYc
InChI InChI=1S/C9H9NO6S/c11-8(12)5-10-17(15,16)7-3-1-6(2-4-7)9(13)14/h1-4,10H,5H2,(H,11,12)(H,13,14)
InChIKey YFZZDGSDTYCIRR-UHFFFAOYSA-N
Mol Weight 259.23 g/mol
Molecular Formula C9H9NO6S
Exact Mass 259.015058 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8KPsq2kD7u5
Name 4-{[(carboxymethyl)amino]sulfonyl}benzoic acid
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/C9H9NO6S/c11-8(12)5-10-17(15,16)7-3-1-6(2-4-7)9(13)14/h1-4,10H,5H2,(H,11,12)(H,13,14)
InChIKey YFZZDGSDTYCIRR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27240
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: D75708; Labnumber: BAUL-1728; SBI_ID: SBI-027244
Temperature 306 °C