| SpectraBase Compound ID | 8jvgK4TiX54 |
|---|---|
| InChI | InChI=1S/C17H19NO2/c1-10-4-6-12(7-5-10)13-9-15-14(8-11(13)2)16(19)18(3)17(15)20/h4-7,14-15H,8-9H2,1-3H3 |
| InChIKey | NOSLMOQXZWQYQH-UHFFFAOYSA-N |
| Mol Weight | 269.34 g/mol |
| Molecular Formula | C17H19NO2 |
| Exact Mass | 269.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HuCZxLHxvOH |
|---|---|
| Name | 2,5-Dimethyl-6-p-tolyl-3A,4,7,7A-tetrahydroisoindole-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.141578854 u |
| Formula | C17H19NO2 |
| InChI | InChI=1S/C17H19NO2/c1-10-4-6-12(7-5-10)13-9-15-14(8-11(13)2)16(19)18(3)17(15)20/h4-7,14-15H,8-9H2,1-3H3 |
| InChIKey | NOSLMOQXZWQYQH-UHFFFAOYSA-N |
| SMILES | C1(N(C(C2CC(=C(CC12)C=1C=CC(=CC1)C)C)=O)C)=O |