| SpectraBase Compound ID | ERAfu3x08wq |
|---|---|
| InChI | InChI=1S/C9H10BrFO/c1-2-5-12-9-4-3-7(11)6-8(9)10/h3-4,6H,2,5H2,1H3 |
| InChIKey | MZASMHWXAIRSKJ-UHFFFAOYSA-N |
| Mol Weight | 233.08 g/mol |
| Molecular Formula | C9H10BrFO |
| Exact Mass | 231.989906 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 97dvASlrE45 |
|---|---|
| Name | 2-Bromo-4-fluoro-1-propoxybenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.989906104 u |
| Formula | C9H10BrFO |
| InChI | InChI=1S/C9H10BrFO/c1-2-5-12-9-4-3-7(11)6-8(9)10/h3-4,6H,2,5H2,1H3 |
| InChIKey | MZASMHWXAIRSKJ-UHFFFAOYSA-N |
| Molecular Weight | 233.080 g/mol |
| SMILES | C1(=C(C=C(C=C1)F)Br)OCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.83461 |