![4-[3-Hydroxy-2-(2-propenyl)phenoxy]benzoic acid ethyl ester](/api/spectrum/4gsVTJVUuCJ/structure.png?h=300&w=458 "4-[3-Hydroxy-2-(2-propenyl)phenoxy]benzoic acid ethyl ester")
| SpectraBase Compound ID | GjQgZaNy2kL |
|---|---|
| InChI | InChI=1S/C18H18O4/c1-3-6-15-16(19)7-5-8-17(15)22-14-11-9-13(10-12-14)18(20)21-4-2/h3,5,7-12,19H,1,4,6H2,2H3 |
| InChIKey | HLARXQNKSFBZLO-UHFFFAOYSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C18H18O4 |
| Exact Mass | 298.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4gsVTJVUuCJ |
|---|---|
| Name | 4-[3-Hydroxy-2-(2-propenyl)phenoxy]benzoic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.120509056 u |
| Formula | C18H18O4 |
| InChI | InChI=1S/C18H18O4/c1-3-6-15-16(19)7-5-8-17(15)22-14-11-9-13(10-12-14)18(20)21-4-2/h3,5,7-12,19H,1,4,6H2,2H3 |
| InChIKey | HLARXQNKSFBZLO-UHFFFAOYSA-N |
| SMILES | C(C=1C=CC(=CC1)OC=1C(=C(C=CC1)O)CC=C)(=O)OCC |