| SpectraBase Compound ID | EnFNgw62xmI |
|---|---|
| InChI | InChI=1S/C12H13NO2S2/c1-3-15-9-4-5-10-11(6-9)17-12(13-10)16-7-8(2)14/h4-6H,3,7H2,1-2H3 |
| InChIKey | IMFIPTZFXQNPLE-UHFFFAOYSA-N |
| Mol Weight | 267.36 g/mol |
| Molecular Formula | C12H13NO2S2 |
| Exact Mass | 267.038771 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GHXKqLsb3Lb |
|---|---|
| Name | Propan-2-one, 1-(6-ethoxy-2-benzothiazolylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.038771009 u |
| Formula | C12H13NO2S2 |
| InChI | InChI=1S/C12H13NO2S2/c1-3-15-9-4-5-10-11(6-9)17-12(13-10)16-7-8(2)14/h4-6H,3,7H2,1-2H3 |
| InChIKey | IMFIPTZFXQNPLE-UHFFFAOYSA-N |
| SMILES | C1(=NC2=CC=C(OCC)C=C2S1)SCC(C)=O |