| SpectraBase Compound ID | BJ7p5ptVB9Q |
|---|---|
| InChI | InChI=1S/C17H18O2S/c1-15-10-12-17(13-11-15)20(18,19)14-6-5-9-16-7-3-2-4-8-16/h2-8,10-13H,9,14H2,1H3/b6-5- |
| InChIKey | ALFHVXOGDVIACQ-WAYWQWQTSA-N |
| Mol Weight | 286.39 g/mol |
| Molecular Formula | C17H18O2S |
| Exact Mass | 286.102751 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LU5c4gso2Me |
|---|---|
| Name | (Z)-4-Phenyl-1-tosyl-2-butene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.102750992 u |
| Formula | C17H18O2S |
| InChI | InChI=1S/C17H18O2S/c1-15-10-12-17(13-11-15)20(18,19)14-6-5-9-16-7-3-2-4-8-16/h2-8,10-13H,9,14H2,1H3/b6-5- |
| InChIKey | ALFHVXOGDVIACQ-WAYWQWQTSA-N |
| SMILES | C(\C=C/CC=1C=CC=CC1)S(=O)(=O)C=1C=CC(C)=CC1 |