![2-[2-(4-Methyl-1,3-thiazol-5-yl)ethyl]isoindole-1,3-dione](/api/spectrum/7aD8kRghlr5/structure.png?h=300&w=458 "2-[2-(4-Methyl-1,3-thiazol-5-yl)ethyl]isoindole-1,3-dione")
| SpectraBase Compound ID | CxVLK0y2vXH |
|---|---|
| InChI | InChI=1S/C14H12N2O2S/c1-9-12(19-8-15-9)6-7-16-13(17)10-4-2-3-5-11(10)14(16)18/h2-5,8H,6-7H2,1H3 |
| InChIKey | VQVGTGLZTBUTQY-UHFFFAOYSA-N |
| Mol Weight | 272.32 g/mol |
| Molecular Formula | C14H12N2O2S |
| Exact Mass | 272.061949 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7aD8kRghlr5 |
|---|---|
| Name | 2-[2-(4-Methyl-1,3-thiazol-5-yl)ethyl]isoindole-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.061948806 u |
| Formula | C14H12N2O2S |
| InChI | InChI=1S/C14H12N2O2S/c1-9-12(19-8-15-9)6-7-16-13(17)10-4-2-3-5-11(10)14(16)18/h2-5,8H,6-7H2,1H3 |
| InChIKey | VQVGTGLZTBUTQY-UHFFFAOYSA-N |
| SMILES | C(CN1C(=O)C2=CC=CC=C2C1=O)C=1SC=NC1C |