| SpectraBase Compound ID | Bj9P7HH8Tcj |
|---|---|
| InChI | InChI=1S/C14H14N2/c15-10-12-4-6-13(7-5-12)14(11-16)8-2-1-3-9-14/h4-7H,1-3,8-9H2 |
| InChIKey | SYUPLHKPEJZFPN-UHFFFAOYSA-N |
| Mol Weight | 210.28 g/mol |
| Molecular Formula | C14H14N2 |
| Exact Mass | 210.115698 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Zb2V3VnIgW |
|---|---|
| Name | 4-(1-Cyanocyclohexyl)benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.115698459 u |
| Formula | C14H14N2 |
| InChI | InChI=1S/C14H14N2/c15-10-12-4-6-13(7-5-12)14(11-16)8-2-1-3-9-14/h4-7H,1-3,8-9H2 |
| InChIKey | SYUPLHKPEJZFPN-UHFFFAOYSA-N |
| Molecular Weight | 210.280 g/mol |
| SMILES | C1CC(C=2C=CC(=CC2)C#N)(CCC1)C#N |