| SpectraBase Spectrum ID |
E9NMcsOhLs3 |
| Name |
L-Proline, N-(2-fluoro-3-trifluoromethylbenzoyl)-, heptyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
403.177056318 u |
| Formula |
C20H25F4NO3 |
| InChI |
InChI=1S/C20H25F4NO3/c1-2-3-4-5-6-13-28-19(27)16-11-8-12-25(16)18(26)14-9-7-10-15(17(14)21)20(22,23)24/h7,9-10,16H,2-6,8,11-13H2,1H3 |
| InChIKey |
GCJGWEBWTXGVSB-UHFFFAOYSA-N |
| Molecular Weight |
403.418 g/mol |
| SMILES |
C(N1CCCC1C(=O)OCCCCCCC)(=O)C1=CC=CC(=C1F)C(F)(F)F |
