SpectraBase Spectrum ID |
4GtSUaPhZQ1 |
Name |
L-Proline, N-(2,4-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/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-33-27(32)25-16-15-19-30(25)26(31)23-18-17-22(28)21-24(23)29/h17-18,21,25H,2-16,19-20H2,1H3 |
InChIKey |
FTKAXAADANXLHT-UHFFFAOYSA-N |
Molecular Weight |
465.626 g/mol |
SMILES |
C1=C(C(=CC=C1F)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCC)=O)F |