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4-azido-2-methyl-6-nitro-1,2-benzisothiazol-3(2H)-one

View entire compound with spectra: 1 NMR

4-azido-2-methyl-6-nitro-1,2-benzisothiazol-3(2H)-one
SpectraBase Compound ID D7kYmV3Ucq9
InChI InChI=1S/C8H5N5O3S/c1-12-8(14)7-5(10-11-9)2-4(13(15)16)3-6(7)17-12/h2-3H,1H3
InChIKey LNDJLVPWSWYRGZ-UHFFFAOYSA-N
Mol Weight 251.22 g/mol
Molecular Formula C8H5N5O3S
Exact Mass 251.01131 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9kW6UPx4JsV
Name 4-azido-2-methyl-6-nitro-1,2-benzisothiazol-3(2H)-one
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/C8H5N5O3S/c1-12-8(14)7-5(10-11-9)2-4(13(15)16)3-6(7)17-12/h2-3H,1H3
InChIKey LNDJLVPWSWYRGZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_4595
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/9211009; Labnumber: L-12,Kyslitzin; IOH_ID: IOH-004596
Temperature 303 °C