| SpectraBase Spectrum ID |
FQdDsPKCAyH |
| Name |
4-Bromo-2-(trifluoromethoxy)aniline, 2ac derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.971790640 u |
| Formula |
C11H9BrF3NO3 |
| InChI |
InChI=1S/C11H9BrF3NO3/c1-6(17)16(7(2)18)9-4-3-8(12)5-10(9)19-11(13,14)15/h3-5H,1-2H3 |
| InChIKey |
RQHIYVDKQGRWPP-UHFFFAOYSA-N |
| Molecular Weight |
340.096 g/mol |
| SMILES |
C(F)(F)(F)OC1=C(C=CC(=C1)Br)N(C(C)=O)C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919329 |
