| SpectraBase Compound ID | 4swpggQSC0h |
|---|---|
| InChI | InChI=1S/C10H11N/c1-2-3-9-4-6-10(8-11)7-5-9/h4-7H,2-3H2,1H3 |
| InChIKey | HEIAAGNBEHLVCZ-UHFFFAOYSA-N |
| Mol Weight | 145.2 g/mol |
| Molecular Formula | C10H11N |
| Exact Mass | 145.089149 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5mB6Do9Tv8C |
|---|---|
| Name | 4-Propylbenzenecarbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 145.089149358 u |
| Formula | C10H11N |
| InChI | InChI=1S/C10H11N/c1-2-3-9-4-6-10(8-11)7-5-9/h4-7H,2-3H2,1H3 |
| InChIKey | HEIAAGNBEHLVCZ-UHFFFAOYSA-N |
| Molecular Weight | 145.205 g/mol |
| SMILES | C(#N)C1=CC=C(C=C1)CCC |