| SpectraBase Spectrum ID |
6IWpBRv9twW |
| Name |
1-(m-Bromophenyl)-3-(trifluoromethyl)pyrrolidine-2,5-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.961225956 u |
| Formula |
C11H7BrF3NO2 |
| InChI |
InChI=1S/C11H7BrF3NO2/c12-6-2-1-3-7(4-6)16-9(17)5-8(10(16)18)11(13,14)15/h1-4,8H,5H2 |
| InChIKey |
OLEOMSDXIWJOAY-UHFFFAOYSA-N |
| Molecular Weight |
322.081 g/mol |
| SMILES |
C1(N(C(CC1C(F)(F)F)=O)C=1C=C(C=CC1)Br)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863678 |
