![Ethanol, 2-[(4-chlorophenyl)sulfonyl]-](/api/spectrum/2zvqatTdnLn/structure.png?h=300&w=458 "Ethanol, 2-[(4-chlorophenyl)sulfonyl]-")
| SpectraBase Compound ID | JXxslpmwAXc |
|---|---|
| InChI | InChI=1S/C8H9ClO3S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4,10H,5-6H2 |
| InChIKey | PERNWOCEJUZDKC-UHFFFAOYSA-N |
| Mol Weight | 220.67 g/mol |
| Molecular Formula | C8H9ClO3S |
| Exact Mass | 219.996093 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2zvqatTdnLn |
|---|---|
| Name | Ethanol, 2-[(4-chlorophenyl)sulfonyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.996093021 u |
| Formula | C8H9ClO3S |
| InChI | InChI=1S/C8H9ClO3S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4,10H,5-6H2 |
| InChIKey | PERNWOCEJUZDKC-UHFFFAOYSA-N |
| SMILES | C=1(S(CCO)(=O)=O)C=CC(=CC1)Cl |