| SpectraBase Compound ID | efKpN3mrJp |
|---|---|
| InChI | InChI=1S/C18H16O5/c1-3-22-18(20)16-14-10-12(19)6-9-15(14)23-17(16)11-4-7-13(21-2)8-5-11/h4-10,19H,3H2,1-2H3 |
| InChIKey | BXQIVOMSRNFTNH-UHFFFAOYSA-N |
| Mol Weight | 312.32 g/mol |
| Molecular Formula | C18H16O5 |
| Exact Mass | 312.099774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9sDFcCdpTF0 |
|---|---|
| Name | 2-(4-Methoxyphenyl)-3-ethoxycarbonyl-5-hydroxybenzofuran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.099773610 u |
| Formula | C18H16O5 |
| InChI | InChI=1S/C18H16O5/c1-3-22-18(20)16-14-10-12(19)6-9-15(14)23-17(16)11-4-7-13(21-2)8-5-11/h4-10,19H,3H2,1-2H3 |
| InChIKey | BXQIVOMSRNFTNH-UHFFFAOYSA-N |
| SMILES | Oc1cc2C(=C(Oc2cc1)c1ccc(cc1)OC)C(=O)OCC |