| SpectraBase Spectrum ID |
DFyxjpc06Q7 |
| Name |
L-Valine, N-(3-trifluoromethylbenzoyl)-, heptadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
527.358628896 u |
| Formula |
C30H48F3NO3 |
| InChI |
InChI=1S/C30H48F3NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-37-29(36)27(24(2)3)34-28(35)25-20-19-21-26(23-25)30(31,32)33/h19-21,23-24,27H,4-18,22H2,1-3H3,(H,34,35) |
| InChIKey |
CXFGBRXQGARTPD-UHFFFAOYSA-N |
| Molecular Weight |
527.713 g/mol |
| SMILES |
C(C1=CC=CC(=C1)C(NC(C(C)C)C(=O)OCCCCCCCCCCCCCCCCC)=O)(F)(F)F |
