| SpectraBase Spectrum ID |
A2bbTVw4tz3 |
| Name |
L-Alanine, N-(4-trifluoromethylbenzoyl)-, pentadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
471.296028638 u |
| Formula |
C26H40F3NO3 |
| InChI |
InChI=1S/C26H40F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-33-25(32)21(2)30-24(31)22-16-18-23(19-17-22)26(27,28)29/h16-19,21H,3-15,20H2,1-2H3,(H,30,31) |
| InChIKey |
PXPUULYPPCAGMR-UHFFFAOYSA-N |
| Molecular Weight |
471.605 g/mol |
| SMILES |
C1=CC(=CC=C1C(NC(C(OCCCCCCCCCCCCCCC)=O)C)=O)C(F)(F)F |
