SpectraBase Spectrum ID |
5WVnnan8Ykg |
Name |
20-Fluoro-eicos-11-enoic acid, pyrrolidide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
381.340693203 u |
Formula |
C24H44FNO |
InChI |
InChI=1S/C24H44FNO/c25-21-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-20-24(27)26-22-18-19-23-26/h1,3H,2,4-23H2/b3-1- |
InChIKey |
XGBUTTZGRFWVRY-IWQZZHSRSA-N |
Molecular Weight |
381.620 g/mol |
SMILES |
C(N1CCCC1)(CCCCCCCCC\C=C/CCCCCCCCF)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902548 |