SpectraBase Spectrum ID |
3hcv6ZiIZiD |
Name |
L-Proline, N-(2,6-difluorobenzoyl)-, pentadecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
465.305450507 u |
Formula |
C27H41F2NO3 |
InChI |
InChI=1S/C27H41F2NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-33-27(32)24-19-16-20-30(24)26(31)25-22(28)17-15-18-23(25)29/h15,17-18,24H,2-14,16,19-21H2,1H3 |
InChIKey |
GXDNDIBQXGYHLH-UHFFFAOYSA-N |
Molecular Weight |
465.626 g/mol |
SMILES |
C1=CC=C(C(=C1F)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCC)=O)F |