| SpectraBase Spectrum ID |
4l3mdrEknjb |
| Name |
L-Alanine, N-(2-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/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-33-25(32)21(2)30-24(31)22-18-15-16-19-23(22)26(27,28)29/h15-16,18-19,21H,3-14,17,20H2,1-2H3,(H,30,31) |
| InChIKey |
XZVQPMBPZGRODB-UHFFFAOYSA-N |
| Molecular Weight |
471.605 g/mol |
| SMILES |
C1(=CC=CC=C1C(NC(C)C(OCCCCCCCCCCCCCCC)=O)=O)C(F)(F)F |
