| SpectraBase Compound ID | EePQheLSWdL |
|---|---|
| InChI | InChI=1S/C12H12N2O3S/c1-3-17-11(16)8-4-5-9-10(6-8)18-12(14-9)13-7(2)15/h4-6H,3H2,1-2H3,(H,13,14,15) |
| InChIKey | QAJGZBLGLSUJGX-UHFFFAOYSA-N |
| Mol Weight | 264.3 g/mol |
| Molecular Formula | C12H12N2O3S |
| Exact Mass | 264.056863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K1r6N0zCcuA |
|---|---|
| Name | 2-Acetamido-6-ethoxycarbonylbenzothiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.056863425 u |
| Formula | C12H12N2O3S |
| InChI | InChI=1S/C12H12N2O3S/c1-3-17-11(16)8-4-5-9-10(6-8)18-12(14-9)13-7(2)15/h4-6H,3H2,1-2H3,(H,13,14,15) |
| InChIKey | QAJGZBLGLSUJGX-UHFFFAOYSA-N |
| Molecular Weight | 264.299 g/mol |
| SMILES | N(C=1Sc2cc(ccc2N1)C(OCC)=O)C(=O)C |