| SpectraBase Compound ID | KVVsMKaCIHd |
|---|---|
| InChI | InChI=1S/C10H9N/c1-2-3-9-4-6-10(8-11)7-5-9/h2-7H,1H3/b3-2+ |
| InChIKey | DTFJDKQVJTWWAB-NSCUHMNNSA-N |
| Mol Weight | 143.19 g/mol |
| Molecular Formula | C10H9N |
| Exact Mass | 143.073499 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 716DhEgpm4I |
|---|---|
| Name | (E)-4-(Prop-1-enyl)benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 143.073499294 u |
| Formula | C10H9N |
| InChI | InChI=1S/C10H9N/c1-2-3-9-4-6-10(8-11)7-5-9/h2-7H,1H3/b3-2+ |
| InChIKey | DTFJDKQVJTWWAB-NSCUHMNNSA-N |
| Molecular Weight | 143.189 g/mol |
| SMILES | C=1C=C(\C=C\C)C=CC1C#N |