| SpectraBase Compound ID | 9Z5nUETbeEj |
|---|---|
| InChI | InChI=1S/C17H20O2S/c1-11-6-7-16(13(3)8-11)20(18,19)17-14(4)9-12(2)10-15(17)5/h6-10H,1-5H3 |
| InChIKey | CPJOCRBURRYBGL-UHFFFAOYSA-N |
| Mol Weight | 288.4 g/mol |
| Molecular Formula | C17H20O2S |
| Exact Mass | 288.118401 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Dl1HaCPmGTN |
|---|---|
| Name | 2,2',4,4',6-Pentamethyldiphenylsulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.118401056 u |
| Formula | C17H20O2S |
| InChI | InChI=1S/C17H20O2S/c1-11-6-7-16(13(3)8-11)20(18,19)17-14(4)9-12(2)10-15(17)5/h6-10H,1-5H3 |
| InChIKey | CPJOCRBURRYBGL-UHFFFAOYSA-N |
| SMILES | C1=C(C(=CC(=C1)C)C)S(C1=C(C=C(C=C1C)C)C)(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951956 |