| SpectraBase Spectrum ID |
8QhXyUkrYx6 |
| Name |
L-Valine, N-(3-trifluoromethylbenzoyl)-, heptyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.202128252 u |
| Formula |
C20H28F3NO3 |
| InChI |
InChI=1S/C20H28F3NO3/c1-4-5-6-7-8-12-27-19(26)17(14(2)3)24-18(25)15-10-9-11-16(13-15)20(21,22)23/h9-11,13-14,17H,4-8,12H2,1-3H3,(H,24,25) |
| InChIKey |
NKJPNBPZFBJGCP-UHFFFAOYSA-N |
| Molecular Weight |
387.443 g/mol |
| SMILES |
C(C1=CC=CC(=C1)C(NC(C(C)C)C(=O)OCCCCCCC)=O)(F)(F)F |
