| SpectraBase Spectrum ID |
GWRMOK9eTyk |
| Name |
13-Cyclopent-2-enyl-tridec-4-enoic acid, pyrrolidide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.287514814 u |
| Formula |
C22H37NO |
| InChI |
InChI=1S/C22H37NO/c24-22(23-19-13-14-20-23)18-10-8-6-4-2-1-3-5-7-9-15-21-16-11-12-17-21/h6,8,11,16,21H,1-5,7,9-10,12-15,17-20H2/b8-6+ |
| InChIKey |
GQUDJNOZQLSTTE-SOFGYWHQSA-N |
| Molecular Weight |
331.544 g/mol |
| SMILES |
C1(CCC=C1)CCCCCCCC\C=C\CCC(N1CCCC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921252 |
