| SpectraBase Compound ID | 1e3Lz6MsBcf |
|---|---|
| InChI | InChI=1S/C11H14O2S/c1-10(2)8-9-14(12,13)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3 |
| InChIKey | VHGJFEIINHHUSQ-UHFFFAOYSA-N |
| Mol Weight | 210.29 g/mol |
| Molecular Formula | C11H14O2S |
| Exact Mass | 210.071451 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 50MbhvIl6hd |
|---|---|
| Name | 3-Methylbut-2-enyl-phenyl-sulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.071450863 u |
| Formula | C11H14O2S |
| InChI | InChI=1S/C11H14O2S/c1-10(2)8-9-14(12,13)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3 |
| InChIKey | VHGJFEIINHHUSQ-UHFFFAOYSA-N |
| Molecular Weight | 210.291 g/mol |
| SMILES | C(S(=O)(=O)C1=CC=CC=C1)C=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.823229 |