SpectraBase Spectrum ID |
5A9ttXP46XS |
Name |
L-Proline, N-pentafluoropropionyl-, octadecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
513.324135093 u |
Formula |
C26H44F5NO3 |
InChI |
InChI=1S/C26H44F5NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-35-23(33)22-19-18-20-32(22)24(34)25(27,28)26(29,30)31/h22H,2-21H2,1H3 |
InChIKey |
YCFWYEAJLBQCIK-UHFFFAOYSA-N |
Molecular Weight |
513.634 g/mol |
SMILES |
CCCCCCCCCCCCCCCCCCOC(C1N(CCC1)C(C(C(F)(F)F)(F)F)=O)=O |