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2-{[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)acetyl]amino}-N-isobutylbenzamide
SpectraBase Compound ID 7SDLxZt6IEh
InChI InChI=1S/C20H21N3O5S/c1-13(2)11-21-19(25)14-7-3-5-9-16(14)22-18(24)12-23-20(26)15-8-4-6-10-17(15)29(23,27)28/h3-10,13H,11-12H2,1-2H3,(H,21,25)(H,22,24)
InChIKey VXHUUDOOMNMZMG-UHFFFAOYSA-N
Mol Weight 415.46 g/mol
Molecular Formula C20H21N3O5S
Exact Mass 415.120192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AT7cyBfikFs
Name 2-{[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)acetyl]amino}-N-isobutylbenzamide
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/C20H21N3O5S/c1-13(2)11-21-19(25)14-7-3-5-9-16(14)22-18(24)12-23-20(26)15-8-4-6-10-17(15)29(23,27)28/h3-10,13H,11-12H2,1-2H3,(H,21,25)(H,22,24)
InChIKey VXHUUDOOMNMZMG-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7994
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: D47985; Labnumber: SPDEM4-5946; SBI_ID: SBI-007997
Temperature 308 °C