![3-(4'-Methoxy-[1,1'-biphenyl]-2-yl)benzo[D]isoxazole](/api/spectrum/DwLIYejhmg4/structure.png?h=300&w=458 "3-(4'-Methoxy-[1,1'-biphenyl]-2-yl)benzo[D]isoxazole")
| SpectraBase Compound ID | LIGhpD9UHuG |
|---|---|
| InChI | InChI=1S/C20H15NO2/c1-22-15-12-10-14(11-13-15)16-6-2-3-7-17(16)20-18-8-4-5-9-19(18)23-21-20/h2-13H,1H3 |
| InChIKey | YTPOKPRVVICDAK-UHFFFAOYSA-N |
| Mol Weight | 301.35 g/mol |
| Molecular Formula | C20H15NO2 |
| Exact Mass | 301.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DwLIYejhmg4 |
|---|---|
| Name | 3-(4'-Methoxy-[1,1'-biphenyl]-2-yl)benzo[D]isoxazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.110278725 u |
| Formula | C20H15NO2 |
| InChI | InChI=1S/C20H15NO2/c1-22-15-12-10-14(11-13-15)16-6-2-3-7-17(16)20-18-8-4-5-9-19(18)23-21-20/h2-13H,1H3 |
| InChIKey | YTPOKPRVVICDAK-UHFFFAOYSA-N |
| SMILES | C1(=NOC=2C1=CC=CC2)C1=C(C=CC=C1)C1=CC=C(C=C1)OC |