| SpectraBase Spectrum ID |
5x38mwGszqv |
| Name |
4-Hexadecenoic acid, pyrrolidide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.287514814 u |
| Formula |
C20H37NO |
| InChI |
InChI=1S/C20H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(22)21-18-15-16-19-21/h12-13H,2-11,14-19H2,1H3/b13-12- |
| InChIKey |
NUVZRXFYBBDUJZ-SEYXRHQNSA-N |
| Molecular Weight |
307.522 g/mol |
| SMILES |
C1N(CCC1)C(CC\C=C/CCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850714 |
