| SpectraBase Compound ID | JxvfeolBJRn |
|---|---|
| InChI | InChI=1S/C17H20O2S/c1-5-15-7-6-8-16(11-15)20(18,19)17-13(3)9-12(2)10-14(17)4/h6-11H,5H2,1-4H3 |
| InChIKey | DKARIFPETNPSSJ-UHFFFAOYSA-N |
| Mol Weight | 288.4 g/mol |
| Molecular Formula | C17H20O2S |
| Exact Mass | 288.118401 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dr1BPqmAJmf |
|---|---|
| Name | 2,4,6-Trimethyl-3'-ethyldiphenylsulfone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.118401056 u |
| Formula | C17H20O2S |
| InChI | InChI=1S/C17H20O2S/c1-5-15-7-6-8-16(11-15)20(18,19)17-13(3)9-12(2)10-14(17)4/h6-11H,5H2,1-4H3 |
| InChIKey | DKARIFPETNPSSJ-UHFFFAOYSA-N |
| SMILES | C1(=C(C(=CC(=C1)C)C)S(C1=CC=CC(=C1)CC)(=O)=O)C |