| SpectraBase Compound ID | 9H1hIr16ynq |
|---|---|
| InChI | InChI=1S/C20H15FO3/c21-17-8-6-16(7-9-17)20(22)24-19-12-10-18(11-13-19)23-14-15-4-2-1-3-5-15/h1-13H,14H2 |
| InChIKey | HENSJJMDUPRVGC-UHFFFAOYSA-N |
| Mol Weight | 322.34 g/mol |
| Molecular Formula | C20H15FO3 |
| Exact Mass | 322.100523 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JaLdUA9Seny |
|---|---|
| Name | 4-Fluorobenzoic acid, 4-benzyloxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.100522503 u |
| Formula | C20H15FO3 |
| InChI | InChI=1S/C20H15FO3/c21-17-8-6-16(7-9-17)20(22)24-19-12-10-18(11-13-19)23-14-15-4-2-1-3-5-15/h1-13H,14H2 |
| InChIKey | HENSJJMDUPRVGC-UHFFFAOYSA-N |
| Molecular Weight | 322.335 g/mol |
| SMILES | C1=C(C=CC(=C1)C(OC1=CC=C(C=C1)OCC1=CC=CC=C1)=O)F |