| SpectraBase Compound ID | 3Yp5COU6VzE |
|---|---|
| InChI | InChI=1S/C9H9BrO2/c10-5-6-12-9-3-1-8(7-11)2-4-9/h1-4,7H,5-6H2 |
| InChIKey | XFHTVCMRNSBQCF-UHFFFAOYSA-N |
| Mol Weight | 229.07 g/mol |
| Molecular Formula | C9H9BrO2 |
| Exact Mass | 227.978593 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8GXhvb8u6Qs |
|---|---|
| Name | 4-(2-Bromoethoxy)benzaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.978592528 u |
| Formula | C9H9BrO2 |
| InChI | InChI=1S/C9H9BrO2/c10-5-6-12-9-3-1-8(7-11)2-4-9/h1-4,7H,5-6H2 |
| InChIKey | XFHTVCMRNSBQCF-UHFFFAOYSA-N |
| Molecular Weight | 229.073 g/mol |
| SMILES | C(Br)COC1=CC=C(C=C1)C=O |