| SpectraBase Spectrum ID |
2W6KOoNtASv |
| Name |
L-Proline, N-(2-fluoro-5-trifluoromethylbenzoyl)-, isohexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.161406254 u |
| Formula |
C19H23F4NO3 |
| InChI |
InChI=1S/C19H23F4NO3/c1-12(2)5-4-10-27-18(26)16-6-3-9-24(16)17(25)14-11-13(19(21,22)23)7-8-15(14)20/h7-8,11-12,16H,3-6,9-10H2,1-2H3 |
| InChIKey |
ILHIEHCPZVQLIT-UHFFFAOYSA-N |
| Molecular Weight |
389.391 g/mol |
| SMILES |
C1=C(C(=CC(=C1)C(F)(F)F)C(N1CCCC1C(OCCCC(C)C)=O)=O)F |
