| SpectraBase Compound ID | LiaPT8PiiGC |
|---|---|
| InChI | InChI=1S/C15H9BrO/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9H |
| InChIKey | RMGMSDVPCZWQME-UHFFFAOYSA-N |
| Mol Weight | 285.14 g/mol |
| Molecular Formula | C15H9BrO |
| Exact Mass | 283.983678 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IopxFsrFuSX |
|---|---|
| Name | 3-Bromo-2-phenylinden-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.983677909 u |
| Formula | C15H9BrO |
| InChI | InChI=1S/C15H9BrO/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9H |
| InChIKey | RMGMSDVPCZWQME-UHFFFAOYSA-N |
| SMILES | C1=CC=C2C(=C1)C(C(=C2Br)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.922245 |