| SpectraBase Spectrum ID |
HuareC48XlS |
| Name |
N-p-Bromobenzoyl-.alpha.-amino p-bromoacetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.915654596 u |
| Formula |
C15H11Br2NO2 |
| InChI |
InChI=1S/C15H11Br2NO2/c16-12-5-1-10(2-6-12)14(19)9-18-15(20)11-3-7-13(17)8-4-11/h1-8H,9H2,(H,18,20) |
| InChIKey |
KRAHIBFGPCQQTL-UHFFFAOYSA-N |
| Molecular Weight |
397.066 g/mol |
| SMILES |
C1(=CC=C(C=C1)Br)C(NCC(C1=CC=C(C=C1)Br)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945315 |
