| SpectraBase Compound ID | 8wsjF7EvqSX |
|---|---|
| InChI | InChI=1S/C20H15FO3/c21-17-8-4-7-16(13-17)20(22)24-19-11-9-18(10-12-19)23-14-15-5-2-1-3-6-15/h1-13H,14H2 |
| InChIKey | VITWHNCNPZBBSV-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 | 3KW1pQ7MIlm |
|---|---|
| Name | 3-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/c21-17-8-4-7-16(13-17)20(22)24-19-11-9-18(10-12-19)23-14-15-5-2-1-3-6-15/h1-13H,14H2 |
| InChIKey | VITWHNCNPZBBSV-UHFFFAOYSA-N |
| Molecular Weight | 322.335 g/mol |
| SMILES | C1(=CC=CC(=C1)C(OC1=CC=C(C=C1)OCC1=CC=CC=C1)=O)F |