| SpectraBase Spectrum ID |
92ibzEf0D11 |
| Name |
N-(6-Bromo-2-oxo-2H-chromen-3-yl)nicotinamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.979655155 u |
| Formula |
C15H9BrN2O3 |
| InChI |
InChI=1S/C15H9BrN2O3/c16-11-3-4-13-10(6-11)7-12(15(20)21-13)18-14(19)9-2-1-5-17-8-9/h1-8H,(H,18,19) |
| InChIKey |
IHLQFMMUWLAPOG-UHFFFAOYSA-N |
| Molecular Weight |
345.152 g/mol |
| SMILES |
C1=C(C=C2C(=C1)OC(C(=C2)NC(C1=CN=CC=C1)=O)=O)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930221 |
