| SpectraBase Spectrum ID |
2y8FyPCj6UN |
| Name |
L-Valine, N-(3-trifluoromethylbenzoyl)-, tetradecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
485.311678702 u |
| Formula |
C27H42F3NO3 |
| InChI |
InChI=1S/C27H42F3NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-34-26(33)24(21(2)3)31-25(32)22-17-16-18-23(20-22)27(28,29)30/h16-18,20-21,24H,4-15,19H2,1-3H3,(H,31,32) |
| InChIKey |
HIPYJRUZLYMGBE-UHFFFAOYSA-N |
| Molecular Weight |
485.632 g/mol |
| SMILES |
C1(=CC=CC(=C1)C(NC(C(C)C)C(=O)OCCCCCCCCCCCCCC)=O)C(F)(F)F |
