SpectraBase Spectrum ID |
GQ5t18nvLAB |
Name |
.beta.-Alanine, N-(3-fluorobenzoyl)-, undecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
365.236622054 u |
Formula |
C21H32FNO3 |
InChI |
InChI=1S/C21H32FNO3/c1-2-3-4-5-6-7-8-9-10-16-26-20(24)14-15-23-21(25)18-12-11-13-19(22)17-18/h11-13,17H,2-10,14-16H2,1H3,(H,23,25) |
InChIKey |
PSDRYUPWBWEJLI-UHFFFAOYSA-N |
Molecular Weight |
365.489 g/mol |
SMILES |
C1=C(C=CC=C1C(NCCC(OCCCCCCCCCCC)=O)=O)F |