| SpectraBase Compound ID | CsOUM8DU13B |
|---|---|
| InChI | InChI=1S/C8H8Cl2OS/c9-7-2-1-6(5-8(7)10)12-4-3-11/h1-2,5,11H,3-4H2 |
| InChIKey | BWRURDYHPUVXMI-UHFFFAOYSA-N |
| Mol Weight | 223.12 g/mol |
| Molecular Formula | C8H8Cl2OS |
| Exact Mass | 221.967291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JfkpLI001gI |
|---|---|
| Name | 2-(3,4-Dichlorophenylsulfanyl)-1-ethanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.967291451 u |
| Formula | C8H8Cl2OS |
| InChI | InChI=1S/C8H8Cl2OS/c9-7-2-1-6(5-8(7)10)12-4-3-11/h1-2,5,11H,3-4H2 |
| InChIKey | BWRURDYHPUVXMI-UHFFFAOYSA-N |
| SMILES | C(CSC=1C=C(C(=CC1)Cl)Cl)O |