| SpectraBase Compound ID | 3ulVQjSTauX |
|---|---|
| InChI | InChI=1S/C6H8N4/c7-3-1-2-4-10-6-8-5-9-10/h5-6H,1-2,4H2 |
| InChIKey | JFNOWIAKPASSIE-UHFFFAOYSA-N |
| Mol Weight | 136.16 g/mol |
| Molecular Formula | C6H8N4 |
| Exact Mass | 136.074896 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AbJ8wkPAc1W |
|---|---|
| Name | 4-(1,2,4-Triazol-1-yl)butanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.074896274 u |
| Formula | C6H8N4 |
| InChI | InChI=1S/C6H8N4/c7-3-1-2-4-10-6-8-5-9-10/h5-6H,1-2,4H2 |
| InChIKey | JFNOWIAKPASSIE-UHFFFAOYSA-N |
| SMILES | C=1N=CN(N1)CCCC#N |