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benzoic acid, 3-[5-[(4-carboxyphenyl)sulfonyl]-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl]-
SpectraBase Compound ID K80mOXX9UhU
InChI InChI=1S/C22H13NO8S/c24-19-17-9-8-16(32(30,31)15-6-4-12(5-7-15)21(26)27)11-18(17)20(25)23(19)14-3-1-2-13(10-14)22(28)29/h1-11H,(H,26,27)(H,28,29)
InChIKey XAOYKSCHIGHADV-UHFFFAOYSA-N
Mol Weight 451.41 g/mol
Molecular Formula C22H13NO8S
Exact Mass 451.036188 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GBmcilrP2GD
Name benzoic acid, 3-[5-[(4-carboxyphenyl)sulfonyl]-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl]-
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/C22H13NO8S/c24-19-17-9-8-16(32(30,31)15-6-4-12(5-7-15)21(26)27)11-18(17)20(25)23(19)14-3-1-2-13(10-14)22(28)29/h1-11H,(H,26,27)(H,28,29)
InChIKey XAOYKSCHIGHADV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_1338
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: NMR/11229283