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2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide
SpectraBase Compound ID Hj5idS8ePMt
InChI InChI=1S/C13H11NO6S/c15-9-5-8(10-6-19-13(9)20-10)14-12(16)7-3-1-2-4-11(7)21(14,17)18/h1-4,8,10,13H,5-6H2/t8-,10+,13+/m0/s1
InChIKey ZNMYEXIBTAYDLI-IYYTYJHQSA-N
Mol Weight 309.29 g/mol
Molecular Formula C13H11NO6S
Exact Mass 309.030708 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fsrzzoEttc
Name 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide
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/C13H11NO6S/c15-9-5-8(10-6-19-13(9)20-10)14-12(16)7-3-1-2-4-11(7)21(14,17)18/h1-4,8,10,13H,5-6H2/t8-,10+,13+/m0/s1
InChIKey ZNMYEXIBTAYDLI-IYYTYJHQSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7764
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: ZERO/003012; IOH_ID: IOH-014769