| SpectraBase Compound ID | Gro9wfZeYhG |
|---|---|
| InChI | InChI=1S/C15H12BrFO3/c1-19-14-7-10(8-18)6-12(16)15(14)20-9-11-4-2-3-5-13(11)17/h2-8H,9H2,1H3 |
| InChIKey | SSYNEHJVJMNYRQ-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 | AhDhk0sfVgC |
|---|---|
| Name | Benzaldehyde, 3-bromo-4-(2-fluorobenzyloxy)-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/c1-19-14-7-10(8-18)6-12(16)15(14)20-9-11-4-2-3-5-13(11)17/h2-8H,9H2,1H3 |
| InChIKey | SSYNEHJVJMNYRQ-UHFFFAOYSA-N |
| Molecular Weight | 339.160 g/mol |
| SMILES | C1(=C(C=C(C=C1OC)C=O)Br)OCC1=CC=CC=C1F |