SpectraBase Spectrum ID |
3AKBXQKFyS0 |
Name |
6-Bromo-3-(4-bromophenyl)quinolin-2(1H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
376.905089913 u |
Formula |
C15H9Br2NO |
InChI |
InChI=1S/C15H9Br2NO/c16-11-3-1-9(2-4-11)13-8-10-7-12(17)5-6-14(10)18-15(13)19/h1-8H,(H,18,19) |
InChIKey |
LNIYFXNSOQHGOT-UHFFFAOYSA-N |
Molecular Weight |
379.051 g/mol |
SMILES |
C=1(C=CC=2NC(=O)C(=CC2C1)C=1C=CC(=CC1)Br)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932968 |