![Benzaldehyde, 4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxy-](/api/spectrum/4lj8hvcDOgP/structure.png?h=300&w=458 "Benzaldehyde, 4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxy-")
| SpectraBase Compound ID | 7VWY1IE6X0A |
|---|---|
| InChI | InChI=1S/C15H12ClFO3/c1-19-15-6-10(8-18)2-5-14(15)20-9-11-3-4-12(17)7-13(11)16/h2-8H,9H2,1H3 |
| InChIKey | MBESALXMWMFICO-UHFFFAOYSA-N |
| Mol Weight | 294.71 g/mol |
| Molecular Formula | C15H12ClFO3 |
| Exact Mass | 294.0459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4lj8hvcDOgP |
|---|---|
| Name | Benzaldehyde, 4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.045900106 u |
| Formula | C15H12ClFO3 |
| InChI | InChI=1S/C15H12ClFO3/c1-19-15-6-10(8-18)2-5-14(15)20-9-11-3-4-12(17)7-13(11)16/h2-8H,9H2,1H3 |
| InChIKey | MBESALXMWMFICO-UHFFFAOYSA-N |
| Molecular Weight | 294.709 g/mol |
| SMILES | C1(=CC(=CC=C1COC1=C(C=C(C=O)C=C1)OC)F)Cl |