| SpectraBase Spectrum ID |
KSxiUTw5dSx |
| Name |
2,2,3,3,3-Pentafluoro-N-(3-(4-methoxyphenyl)butan-2-yl)-N-methylpropanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.125769637 u |
| Formula |
C15H18F5NO2 |
| InChI |
InChI=1S/C15H18F5NO2/c1-9(11-5-7-12(23-4)8-6-11)10(2)21(3)13(22)14(16,17)15(18,19)20/h5-10H,1-4H3 |
| InChIKey |
SGHPDOLSNJZJKM-UHFFFAOYSA-N |
| Molecular Weight |
339.306 g/mol |
| SMILES |
C1=CC(=CC=C1C(C(N(C(=O)C(F)(F)C(F)(F)F)C)C)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854924 |
