![2-[(2-Methylphenyl)sulfonyl]ethanol](/api/spectrum/7KvBADBtoWV/structure.png?h=300&w=458 "2-[(2-Methylphenyl)sulfonyl]ethanol")
| SpectraBase Compound ID | Hmk8IoA1cOd |
|---|---|
| InChI | InChI=1S/C9H12O3S/c1-8-4-2-3-5-9(8)13(11,12)7-6-10/h2-5,10H,6-7H2,1H3 |
| InChIKey | MIALPXXPGBZKKS-UHFFFAOYSA-N |
| Mol Weight | 200.25 g/mol |
| Molecular Formula | C9H12O3S |
| Exact Mass | 200.050715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7KvBADBtoWV |
|---|---|
| Name | 2-[(2-Methylphenyl)sulfonyl]ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.050715417 u |
| Formula | C9H12O3S |
| InChI | InChI=1S/C9H12O3S/c1-8-4-2-3-5-9(8)13(11,12)7-6-10/h2-5,10H,6-7H2,1H3 |
| InChIKey | MIALPXXPGBZKKS-UHFFFAOYSA-N |
| Molecular Weight | 200.252 g/mol |
| SMILES | C(S(=O)(=O)C1=C(C=CC=C1)C)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.854594 |