| SpectraBase Spectrum ID |
ClwsWLfJ9SC |
| Name |
2-Methoxybenzylamine, N-pentafluoropropionyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.063169379 u |
| Formula |
C11H10F5NO2 |
| InChI |
InChI=1S/C11H10F5NO2/c1-19-8-5-3-2-4-7(8)6-17-9(18)10(12,13)11(14,15)16/h2-5H,6H2,1H3,(H,17,18) |
| InChIKey |
XPDIQEXHLFBKKR-UHFFFAOYSA-N |
| Molecular Weight |
283.198 g/mol |
| SMILES |
C1(=C(C=CC=C1)CNC(=O)C(F)(C(F)(F)F)F)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854449 |
