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N-(2-methyl-5-nitrophenyl)-1,2-benzisothiazol-3-amine 1,1-dioxide
SpectraBase Compound ID 2VrzXVTEb25
InChI InChI=1S/C14H11N3O4S/c1-9-6-7-10(17(18)19)8-12(9)15-14-11-4-2-3-5-13(11)22(20,21)16-14/h2-8H,1H3,(H,15,16)
InChIKey PGXGIQBLCNLJBP-UHFFFAOYSA-N
Mol Weight 317.32 g/mol
Molecular Formula C14H11N3O4S
Exact Mass 317.047027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LYQ9S3MNUw6
Name N-(2-methyl-5-nitrophenyl)-1,2-benzisothiazol-3-amine 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/C14H11N3O4S/c1-9-6-7-10(17(18)19)8-12(9)15-14-11-4-2-3-5-13(11)22(20,21)16-14/h2-8H,1H3,(H,15,16)
InChIKey PGXGIQBLCNLJBP-UHFFFAOYSA-N
NMR Offset 15.1248
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_2397
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: ZI/5127365; Labnumber: LP-NPC043; IOH_ID: IOH-002398
Synonyms N-(1,1-dioxido-1,2-benzisothiazol-3-yl)-N-(2-methyl-5-nitrophenyl)amine
Temperature 313 °C