| SpectraBase Spectrum ID |
HxEi2GoaY6b |
| Name |
Benzamide, 2-bromo-N-(2-bromobenzoyl)-N-isobutyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.962604789 u |
| Formula |
C18H17Br2NO2 |
| InChI |
InChI=1S/C18H17Br2NO2/c1-12(2)11-21(17(22)13-7-3-5-9-15(13)19)18(23)14-8-4-6-10-16(14)20/h3-10,12H,11H2,1-2H3 |
| InChIKey |
DUHNWGIQJIDONT-UHFFFAOYSA-N |
| Molecular Weight |
439.147 g/mol |
| SMILES |
C1=CC=C(C(=C1)Br)C(N(CC(C)C)C(=O)C1=C(C=CC=C1)Br)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828206 |
