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N-(2-Nitrophenylthio)saccharin

View entire compound with spectra: 2 NMR, and 1 FTIR

N-(2-Nitrophenylthio)saccharin
SpectraBase Compound ID DvN8mf2WQu
InChI InChI=1S/C13H8N2O5S2/c16-13-9-5-1-4-8-12(9)22(19,20)15(13)21-11-7-3-2-6-10(11)14(17)18/h1-8H
InChIKey XTEABMFZLAEEKX-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C13H8N2O5S2
Exact Mass 335.987464 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LWMHlPjKTWa
Name N-(2-Nitrophenylthio)saccharin
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 305731
CAS Registry Number 16239-03-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8N2O5S2
InChI InChI=1S/C13H8N2O5S2/c16-13-9-5-1-4-8-12(9)22(19,20)15(13)21-11-7-3-2-6-10(11)14(17)18/h1-8H
InChIKey XTEABMFZLAEEKX-UHFFFAOYSA-N
Observed nucleus 13C
Purity 95%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_006074