| SpectraBase Compound ID | GinONBw6hsN |
|---|---|
| InChI | InChI=1S/C19H27NO2/c1-2-3-4-5-6-7-8-9-10-15-22-19(21)18-13-11-17(16-20)12-14-18/h11-14H,2-10,15H2,1H3 |
| InChIKey | CERKUVNHDXVIQZ-UHFFFAOYSA-N |
| Mol Weight | 301.43 g/mol |
| Molecular Formula | C19H27NO2 |
| Exact Mass | 301.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HCI7pWr1PTL |
|---|---|
| Name | 4-Cyanobenzoic acid, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.204179111 u |
| Formula | C19H27NO2 |
| InChI | InChI=1S/C19H27NO2/c1-2-3-4-5-6-7-8-9-10-15-22-19(21)18-13-11-17(16-20)12-14-18/h11-14H,2-10,15H2,1H3 |
| InChIKey | CERKUVNHDXVIQZ-UHFFFAOYSA-N |
| SMILES | C(OCCCCCCCCCCC)(=O)C=1C=CC(C#N)=CC1 |