SpectraBase Spectrum ID |
JkEeXg3aGf2 |
Name |
L-Proline, N-(3-fluorobenzoyl)-, hexadecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
461.330522441 u |
Formula |
C28H44FNO3 |
InChI |
InChI=1S/C28H44FNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-33-28(32)26-20-17-21-30(26)27(31)24-18-16-19-25(29)23-24/h16,18-19,23,26H,2-15,17,20-22H2,1H3 |
InChIKey |
PCJAHXKWIHOMIG-UHFFFAOYSA-N |
Molecular Weight |
461.662 g/mol |
SMILES |
C1(=CC(=CC=C1)F)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCCC)=O |