![3-[Hydroxy(4-methylphenyl)methyl]-1-benzofuran-5-ol](/api/spectrum/CSwUT9QCKR9/structure.png?h=300&w=458 "3-[Hydroxy(4-methylphenyl)methyl]-1-benzofuran-5-ol")
| SpectraBase Compound ID | Fn6dpulXwb8 |
|---|---|
| InChI | InChI=1S/C16H14O3/c1-10-2-4-11(5-3-10)16(18)14-9-19-15-7-6-12(17)8-13(14)15/h2-9,16-18H,1H3 |
| InChIKey | KWSRPOMWDPYWQN-UHFFFAOYSA-N |
| Mol Weight | 254.28 g/mol |
| Molecular Formula | C16H14O3 |
| Exact Mass | 254.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CSwUT9QCKR9 |
|---|---|
| Name | 3-[Hydroxy(4-methylphenyl)methyl]-1-benzofuran-5-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.094294308 u |
| Formula | C16H14O3 |
| InChI | InChI=1S/C16H14O3/c1-10-2-4-11(5-3-10)16(18)14-9-19-15-7-6-12(17)8-13(14)15/h2-9,16-18H,1H3 |
| InChIKey | KWSRPOMWDPYWQN-UHFFFAOYSA-N |
| Molecular Weight | 254.285 g/mol |
| SMILES | OC1=CC=C2C(C(C(C=3C=CC(=CC3)C)O)=CO2)=C1 |