| SpectraBase Spectrum ID |
CbEHNhsx1KJ |
| Name |
2-Bromo-3-(4-nitrophenyl)-1H-indene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.989491564 u |
| Formula |
C15H10BrNO2 |
| InChI |
InChI=1S/C15H10BrNO2/c16-14-9-11-3-1-2-4-13(11)15(14)10-5-7-12(8-6-10)17(18)19/h1-8H,9H2 |
| InChIKey |
KDAQAKKEMJHSEL-UHFFFAOYSA-N |
| Molecular Weight |
316.154 g/mol |
| SMILES |
C1(=C(C2=CC=CC=C2C1)C=1C=CC(N(=O)=O)=CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872893 |