| SpectraBase Compound ID | 1l0tLtTttUM |
|---|---|
| InChI | InChI=1S/C12H14OS2/c13-11(10-5-2-1-3-6-10)9-12-14-7-4-8-15-12/h1-3,5-6,12H,4,7-9H2 |
| InChIKey | YQCIJGFKQXGOCN-UHFFFAOYSA-N |
| Mol Weight | 238.36 g/mol |
| Molecular Formula | C12H14OS2 |
| Exact Mass | 238.048607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G8HC3aKfBvl |
|---|---|
| Name | 2-(1,3-Dithian-2-yl)-1-phenyl-ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.048607418 u |
| Formula | C12H14OS2 |
| InChI | InChI=1S/C12H14OS2/c13-11(10-5-2-1-3-6-10)9-12-14-7-4-8-15-12/h1-3,5-6,12H,4,7-9H2 |
| InChIKey | YQCIJGFKQXGOCN-UHFFFAOYSA-N |
| Molecular Weight | 238.363 g/mol |
| SMILES | C(C(=O)C1=CC=CC=C1)C1SCCCS1 |