![3-nitro-2-[(4H-1,2,4-triazol-3-yl)thio]pyridine](/api/spectrum/2fxTckG1PJA/structure.png?h=300&w=458 "3-nitro-2-[(4H-1,2,4-triazol-3-yl)thio]pyridine")
| SpectraBase Compound ID | 197Nx4F03Dv |
|---|---|
| InChI | InChI=1S/C7H5N5O2S/c13-12(14)5-2-1-3-8-6(5)15-7-9-4-10-11-7/h1-4H,(H,9,10,11) |
| InChIKey | RYWUKFAXVSVNFV-UHFFFAOYSA-N |
| Mol Weight | 223.21 g/mol |
| Molecular Formula | C7H5N5O2S |
| Exact Mass | 223.016396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2fxTckG1PJA |
|---|---|
| Name | 3-Nitro-2-[(4H-1,2,4-triazol-3-yl)thio]pyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.016395593 u |
| Formula | C7H5N5O2S |
| InChI | InChI=1S/C7H5N5O2S/c13-12(14)5-2-1-3-8-6(5)15-7-9-4-10-11-7/h1-4H,(H,9,10,11) |
| InChIKey | RYWUKFAXVSVNFV-UHFFFAOYSA-N |
| Molecular Weight | 223.210 g/mol |
| SMILES | N1C(SC2=NC=CC=C2N(=O)=O)=NN=C1 |