SpectraBase Spectrum ID |
6KOoYbLxnA6 |
Name |
L-Alanine, N-(3-fluorobenzoyl)-, pentadecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
421.299222312 u |
Formula |
C25H40FNO3 |
InChI |
InChI=1S/C25H40FNO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-30-25(29)21(2)27-24(28)22-17-16-18-23(26)20-22/h16-18,20-21H,3-15,19H2,1-2H3,(H,27,28) |
InChIKey |
FZZGHABJHIEIRH-UHFFFAOYSA-N |
Molecular Weight |
421.597 g/mol |
SMILES |
C1=C(C=CC=C1C(NC(C(OCCCCCCCCCCCCCCC)=O)C)=O)F |