![Benzaldehyde, 3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-](/api/spectrum/7VObLMDk7S2/structure.png?h=300&w=458 "Benzaldehyde, 3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-")
| SpectraBase Compound ID | IAft0EDrMn7 |
|---|---|
| InChI | InChI=1S/C15H12BrFO3/c1-19-14-7-11(8-18)6-13(16)15(14)20-9-10-2-4-12(17)5-3-10/h2-8H,9H2,1H3 |
| InChIKey | KFWBNKUHCNGZRM-UHFFFAOYSA-N |
| Mol Weight | 339.16 g/mol |
| Molecular Formula | C15H12BrFO3 |
| Exact Mass | 337.995385 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7VObLMDk7S2 |
|---|---|
| Name | Benzaldehyde, 3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.995385406 u |
| Formula | C15H12BrFO3 |
| InChI | InChI=1S/C15H12BrFO3/c1-19-14-7-11(8-18)6-13(16)15(14)20-9-10-2-4-12(17)5-3-10/h2-8H,9H2,1H3 |
| InChIKey | KFWBNKUHCNGZRM-UHFFFAOYSA-N |
| Molecular Weight | 339.160 g/mol |
| SMILES | C1=CC(=CC=C1COC1=C(C=C(C=O)C=C1Br)OC)F |