| SpectraBase Compound ID | 1jRubVCNlCe |
|---|---|
| InChI | InChI=1S/C8H11N3/c9-5-2-1-3-7-11-8-4-6-10-11/h4,6,8H,1-3,7H2 |
| InChIKey | AAWQZZSHGSBNGR-UHFFFAOYSA-N |
| Mol Weight | 149.2 g/mol |
| Molecular Formula | C8H11N3 |
| Exact Mass | 149.095297 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HYcI8ZDuXQh |
|---|---|
| Name | 1H-Pyrazole-1-pentanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 149.095297366 u |
| Formula | C8H11N3 |
| InChI | InChI=1S/C8H11N3/c9-5-2-1-3-7-11-8-4-6-10-11/h4,6,8H,1-3,7H2 |
| InChIKey | AAWQZZSHGSBNGR-UHFFFAOYSA-N |
| Molecular Weight | 149.197 g/mol |
| SMILES | C1=NN(CCCCC#N)C=C1 |