| SpectraBase Spectrum ID |
9GcwxxkFEzN |
| Name |
2-Tert-butylaniline, N-pentafluoropropionyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.099554889 u |
| Formula |
C13H14F5NO |
| InChI |
InChI=1S/C13H14F5NO/c1-11(2,3)8-6-4-5-7-9(8)19-10(20)12(14,15)13(16,17)18/h4-7H,1-3H3,(H,19,20) |
| InChIKey |
WQLMZDUFYZLJCP-UHFFFAOYSA-N |
| Molecular Weight |
295.253 g/mol |
| SMILES |
C(C)(C)(C)C1=C(NC(C(C(F)(F)F)(F)F)=O)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842176 |
