| SpectraBase Compound ID | 203TkN4OJ1m |
|---|---|
| InChI | InChI=1S/C9H7BrO/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-4,6H,5H2 |
| InChIKey | YTNWANXDKHOVBF-UHFFFAOYSA-N |
| Mol Weight | 211.06 g/mol |
| Molecular Formula | C9H7BrO |
| Exact Mass | 209.968028 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EgvL6Sfj85A |
|---|---|
| Name | 6-Bromanyl-2H-chromene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.968027844 u |
| Formula | C9H7BrO |
| InChI | InChI=1S/C9H7BrO/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-4,6H,5H2 |
| InChIKey | YTNWANXDKHOVBF-UHFFFAOYSA-N |
| Molecular Weight | 211.058 g/mol |
| SMILES | C1C=CC=2C=C(C=CC2O1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94488 |