![2-(Phenylmethylene)-6-isopropoxy-benzo[D]furan-3-one](/api/spectrum/CrY8B9delPD/structure.png?h=300&w=458 "2-(Phenylmethylene)-6-isopropoxy-benzo[D]furan-3-one")
| SpectraBase Compound ID | 3B2Gl2HcNJR |
|---|---|
| InChI | InChI=1S/C18H16O3/c1-12(2)20-14-8-9-15-16(11-14)21-17(18(15)19)10-13-6-4-3-5-7-13/h3-12H,1-2H3/b17-10- |
| InChIKey | NRKIQAUPMFUJCJ-YVLHZVERSA-N |
| Mol Weight | 280.32 g/mol |
| Molecular Formula | C18H16O3 |
| Exact Mass | 280.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CrY8B9delPD |
|---|---|
| Name | 2-(Phenylmethylene)-6-isopropoxy-benzo[D]furan-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.109944372 u |
| Formula | C18H16O3 |
| InChI | InChI=1S/C18H16O3/c1-12(2)20-14-8-9-15-16(11-14)21-17(18(15)19)10-13-6-4-3-5-7-13/h3-12H,1-2H3/b17-10- |
| InChIKey | NRKIQAUPMFUJCJ-YVLHZVERSA-N |
| SMILES | C1(\C(OC2=CC(=CC=C12)OC(C)C)=C\C=1C=CC=CC1)=O |