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Thionicotinamide

View entire compound with spectra: 6 NMR, 5 FTIR, 1 Raman, 2 UV-Vis, and 3 MS (GC)

Thionicotinamide
SpectraBase Compound ID HtVlKDlOItR
InChI InChI=1S/C6H6N2S/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)
InChIKey XQWBMZWDJAZPPX-UHFFFAOYSA-N
Mol Weight 138.19 g/mol
Molecular Formula C6H6N2S
Exact Mass 138.025169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KqB8wWzFRJc
Name Thionicotinamide
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number T31658
CAS Registry Number 4621-66-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6N2S
InChI InChI=1S/C6H6N2S/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)
InChIKey XQWBMZWDJAZPPX-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-Pyridinecarbothioamide Nicotinothioamide
Wiley ID SIAL_1HNMR_012721