| SpectraBase Compound ID | IO0ZBRG7erQ |
|---|---|
| InChI | InChI=1S/C10H12O2S/c1-3-9(2)13(11,12)10-7-5-4-6-8-10/h3-8H,1-2H3/b9-3+ |
| InChIKey | MOEOUHUWFRMXEI-YCRREMRBSA-N |
| Mol Weight | 196.26 g/mol |
| Molecular Formula | C10H12O2S |
| Exact Mass | 196.055801 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LhVWsQfU5hA |
|---|---|
| Name | (E)-(but-2-en-2-Ylsulfonyl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.055800798 u |
| Formula | C10H12O2S |
| InChI | InChI=1S/C10H12O2S/c1-3-9(2)13(11,12)10-7-5-4-6-8-10/h3-8H,1-2H3/b9-3+ |
| InChIKey | MOEOUHUWFRMXEI-YCRREMRBSA-N |
| Molecular Weight | 196.264 g/mol |
| SMILES | C=1(C=CC=CC1)S(=O)(=O)\C(C)=C/C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.88143 |