| SpectraBase Compound ID | IDBWQZTlxdt |
|---|---|
| InChI | InChI=1S/C12H11N/c13-9-8-12(11-6-7-11)10-4-2-1-3-5-10/h1-5,8,11H,6-7H2/b12-8- |
| InChIKey | RIFSAQCTHGUEIX-WQLSENKSSA-N |
| Mol Weight | 169.23 g/mol |
| Molecular Formula | C12H11N |
| Exact Mass | 169.089149 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EeOF24vi8wo |
|---|---|
| Name | 2-Propenenitrile, 3-cyclopropyl-3-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.089149358 u |
| Formula | C12H11N |
| InChI | InChI=1S/C12H11N/c13-9-8-12(11-6-7-11)10-4-2-1-3-5-10/h1-5,8,11H,6-7H2/b12-8- |
| InChIKey | RIFSAQCTHGUEIX-WQLSENKSSA-N |
| Molecular Weight | 169.227 g/mol |
| SMILES | C1(=CC=CC=C1)\C(C1CC1)=C\C#N |