| SpectraBase Spectrum ID |
A3DXa7sPvjZ |
| Name |
2-Bromo-6-nitro-4-trifluoromethoxyaniline, N,N-bis-acetyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.956868850 u |
| Formula |
C11H8BrF3N2O5 |
| InChI |
InChI=1S/C11H8BrF3N2O5/c1-5(18)16(6(2)19)10-8(12)3-7(22-11(13,14)15)4-9(10)17(20)21/h3-4H,1-2H3 |
| InChIKey |
AKNMUYZQNYRRSE-UHFFFAOYSA-N |
| Molecular Weight |
385.093 g/mol |
| SMILES |
C1(N(C(=O)C)C(=O)C)=C(C=C(C=C1N(=O)=O)OC(F)(F)F)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.829417 |
