![2-[2-(4-Methoxyphenyl)-2-oxidanyl-ethyl]isoindole-1,3-dione](/api/spectrum/FPkzj7I2zP0/structure.png?h=300&w=458 "2-[2-(4-Methoxyphenyl)-2-oxidanyl-ethyl]isoindole-1,3-dione")
| SpectraBase Compound ID | LmeFl9z6JHY |
|---|---|
| InChI | InChI=1S/C17H15NO4/c1-22-12-8-6-11(7-9-12)15(19)10-18-16(20)13-4-2-3-5-14(13)17(18)21/h2-9,15,19H,10H2,1H3 |
| InChIKey | HUIDIFPOCJBYLV-UHFFFAOYSA-N |
| Mol Weight | 297.31 g/mol |
| Molecular Formula | C17H15NO4 |
| Exact Mass | 297.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FPkzj7I2zP0 |
|---|---|
| Name | 2-[2-(4-Methoxyphenyl)-2-oxidanyl-ethyl]isoindole-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.100107963 u |
| Formula | C17H15NO4 |
| InChI | InChI=1S/C17H15NO4/c1-22-12-8-6-11(7-9-12)15(19)10-18-16(20)13-4-2-3-5-14(13)17(18)21/h2-9,15,19H,10H2,1H3 |
| InChIKey | HUIDIFPOCJBYLV-UHFFFAOYSA-N |
| Molecular Weight | 297.310 g/mol |
| SMILES | C1(N(C(C2=CC=CC=C12)=O)CC(C=1C=CC(=CC1)OC)O)=O |