| SpectraBase Spectrum ID |
16cfvecaO7W |
| Name |
4-(4-Bromobenzoyl)-1-methyl-3-phenylquinolin-2(1H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.036441757 u |
| Formula |
C23H16BrNO2 |
| InChI |
InChI=1S/C23H16BrNO2/c1-25-19-10-6-5-9-18(19)21(22(26)16-11-13-17(24)14-12-16)20(23(25)27)15-7-3-2-4-8-15/h2-14H,1H3 |
| InChIKey |
YOMPSNKUXUTIRM-UHFFFAOYSA-N |
| Molecular Weight |
418.290 g/mol |
| SMILES |
C1(N(C=2C=CC=CC2C(=C1C=1C=CC=CC1)C(C=1C=CC(=CC1)Br)=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942334 |
