| 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 |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6doxJbGiRth |
|---|---|
| Name | Thionicotinamide |
| CAS Registry Number | 4621-66-3 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 |
| Instrument Name | Varian HA-100 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3/DMSO-D6 |