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N-(Cyanomethyl)-2-naphthalenesulfonamide sodium salt

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

N-(Cyanomethyl)-2-naphthalenesulfonamide sodium salt
SpectraBase Compound ID AIttdFQPXys
InChI InChI=1S/C12H9N2O2S.Na/c13-7-8-14-17(15,16)12-6-5-10-3-1-2-4-11(10)9-12;/h1-6,9H,8H2;/q-1;+1
InChIKey MRIIJWYDHWYXIN-UHFFFAOYSA-N
Mol Weight 268.27 g/mol
Molecular Formula C12H9N2NaO2S
Exact Mass 268.028243 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7uShza4riP7
Name N-(Cyanomethyl)-2-naphthalenesulfonamide sodium salt
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 188654
CAS Registry Number 80866-78-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N2NaO2S
InChI InChI=1S/C12H9N2O2S.Na/c13-7-8-14-17(15,16)12-6-5-10-3-1-2-4-11(10)9-12;/h1-6,9H,8H2;/q-1;+1
InChIKey MRIIJWYDHWYXIN-UHFFFAOYSA-N
Observed nucleus 13C
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Sodium N-(cyanomethyl)naphthalene-2-sulphonamidate sodiumN- naphthalene-2-sulphonamidate
Wiley ID SIAL_13CNMR_002493