| SpectraBase Spectrum ID |
DbGcVTOJoUq |
| Name |
4-Trifluoromethyl-3',4'-dibromobenzophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.881575333 u |
| Formula |
C14H7Br2F3O |
| InChI |
InChI=1S/C14H7Br2F3O/c15-11-6-3-9(7-12(11)16)13(20)8-1-4-10(5-2-8)14(17,18)19/h1-7H |
| InChIKey |
QPVRZHYXEBJBOH-UHFFFAOYSA-N |
| Molecular Weight |
408.012 g/mol |
| SMILES |
C(F)(F)(F)C=1C=CC(=CC1)C(=O)C1=CC(=C(Br)C=C1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943955 |
