![2-[(1-allyl-1H-tetrazol-5-yl)thio]-3-aminopyridine](/api/spectrum/5uUF0bshbWM/structure.png?h=300&w=458 "2-[(1-allyl-1H-tetrazol-5-yl)thio]-3-aminopyridine")
| SpectraBase Compound ID | 8GDubkOOGCw |
|---|---|
| InChI | InChI=1S/C9H10N6S/c1-2-6-15-9(12-13-14-15)16-8-7(10)4-3-5-11-8/h2-5H,1,6,10H2 |
| InChIKey | NIXKDZGMGDDBAH-UHFFFAOYSA-N |
| Mol Weight | 234.28 g/mol |
| Molecular Formula | C9H10N6S |
| Exact Mass | 234.068766 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5uUF0bshbWM |
|---|---|
| Name | 2-[(1-Allyl-1H-tetrazol-5-yl)thio]-3-aminopyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.068765520 u |
| Formula | C9H10N6S |
| InChI | InChI=1S/C9H10N6S/c1-2-6-15-9(12-13-14-15)16-8-7(10)4-3-5-11-8/h2-5H,1,6,10H2 |
| InChIKey | NIXKDZGMGDDBAH-UHFFFAOYSA-N |
| SMILES | NC1=C(N=CC=C1)SC1=NN=NN1CC=C |