| SpectraBase Compound ID | Ec2db3hZaVe |
|---|---|
| InChI | InChI=1S/C12H22O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2 |
| InChIKey | MZUPWNMULGRONZ-UHFFFAOYSA-N |
| Mol Weight | 230.37 g/mol |
| Molecular Formula | C12H22O2S |
| Exact Mass | 230.134051 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EDASb8d8vSP |
|---|---|
| Name | Dicyclohexyl sulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.134051120 u |
| Formula | C12H22O2S |
| InChI | InChI=1S/C12H22O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2 |
| InChIKey | MZUPWNMULGRONZ-UHFFFAOYSA-N |
| Molecular Weight | 230.366 g/mol |
| SMILES | C1CC(CCC1)S(C1CCCCC1)(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.838813 |