| SpectraBase Compound ID | 6vqVdFVTSEd |
|---|---|
| InChI | InChI=1S/C7H8N2/c1-2-3-4-7(5-8)6-9/h4H,2-3H2,1H3 |
| InChIKey | HBFBWIDDAKEXAX-UHFFFAOYSA-N |
| Mol Weight | 120.15 g/mol |
| Molecular Formula | C7H8N2 |
| Exact Mass | 120.068748 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3QLWiDfvehH |
|---|---|
| Name | Propanedinitrile, butylidene- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 120.068748266 u |
| Formula | C7H8N2 |
| InChI | InChI=1S/C7H8N2/c1-2-3-4-7(5-8)6-9/h4H,2-3H2,1H3 |
| InChIKey | HBFBWIDDAKEXAX-UHFFFAOYSA-N |
| Molecular Weight | 120.155 g/mol |
| SMILES | CCCC=C(C#N)C#N |