| SpectraBase Spectrum ID |
7nG7V34LobU |
| Name |
N-Methyl-3-(trifluoromethyl)benzenemethanamine, N-trifluoroacetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
285.058832891 u |
| Formula |
C11H9F6NO |
| InChI |
InChI=1S/C11H9F6NO/c1-18(9(19)11(15,16)17)6-7-3-2-4-8(5-7)10(12,13)14/h2-5H,6H2,1H3 |
| InChIKey |
AMQKDKVTYFDEMG-UHFFFAOYSA-N |
| Molecular Weight |
285.189 g/mol |
| SMILES |
C(F)(F)(F)C1=CC(=CC=C1)CN(C)C(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.86637 |
