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benzoic acid, 2-[[[4-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methylphenyl]sulfonyl]amino]-, methyl ester
SpectraBase Compound ID Blegz3AwWA8
InChI InChI=1S/C20H22N2O7S2/c1-13-11-14(22-19(24)20(2,3)12-30(22,25)26)9-10-17(13)31(27,28)21-16-8-6-5-7-15(16)18(23)29-4/h5-11,21H,12H2,1-4H3
InChIKey SBNUMHQZYQILOE-UHFFFAOYSA-N
Mol Weight 466.52 g/mol
Molecular Formula C20H22N2O7S2
Exact Mass 466.086843 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IDT1Sq6X0Jb
Name benzoic acid, 2-[[[4-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methylphenyl]sulfonyl]amino]-, methyl ester
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/C20H22N2O7S2/c1-13-11-14(22-19(24)20(2,3)12-30(22,25)26)9-10-17(13)31(27,28)21-16-8-6-5-7-15(16)18(23)29-4/h5-11,21H,12H2,1-4H3
InChIKey SBNUMHQZYQILOE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8834
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: F33712; Labnumber: CHEKAN-00451