| SpectraBase Compound ID | IIt1CRTWkM4 |
|---|---|
| InChI | InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h7-8,11-12H,2-6,9-10,13-21H2,1H3/b8-7-,12-11- |
| InChIKey | DLFSGKDLHNJEPK-MQEUWQHPSA-N |
| Mol Weight | 333.6 g/mol |
| Molecular Formula | C22H39NO |
| Exact Mass | 333.303165 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 | ICrIG6RBGNx |
|---|---|
| Name | 11-Octadecadienoic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.303164879 u |
| Formula | C22H39NO |
| InChI | InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h7-8,11-12H,2-6,9-10,13-21H2,1H3/b8-7-,12-11- |
| InChIKey | DLFSGKDLHNJEPK-MQEUWQHPSA-N |
| Molecular Weight | 333.560 g/mol |
| SMILES | C(N1CCCC1)(CCCCC\C=C/CC\C=C/CCCCCC)=O |