| SpectraBase Compound ID | J5nZ3bqyLy2 |
|---|---|
| InChI | InChI=1S/C20H21NO3/c1-11(2)14-6-5-7-15(12(3)4)18(14)21-19(23)16-9-8-13(22)10-17(16)20(21)24/h5-12,22H,1-4H3 |
| InChIKey | LAKWINYVWJPHQW-UHFFFAOYSA-N |
| Mol Weight | 323.39 g/mol |
| Molecular Formula | C20H21NO3 |
| Exact Mass | 323.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1akt2TSj9pu |
|---|---|
| Name | 2-(2,6-Diisopropylphenyl)-5-hydroxyisoindoline-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.152143537 u |
| Formula | C20H21NO3 |
| InChI | InChI=1S/C20H21NO3/c1-11(2)14-6-5-7-15(12(3)4)18(14)21-19(23)16-9-8-13(22)10-17(16)20(21)24/h5-12,22H,1-4H3 |
| InChIKey | LAKWINYVWJPHQW-UHFFFAOYSA-N |
| Molecular Weight | 323.392 g/mol |
| SMILES | CC(C)C1=CC=CC(=C1N1C(=O)C2=C(C1=O)C=C(O)C=C2)C(C)C |