![2-{{2-[(p-chlorophenyl)sulfonyl]ethyl}thio}ethanol, o-chlorobenzoate](/api/spectrum/7EpMfvRykV7/structure.png?h=300&w=458 "2-{{2-[(p-chlorophenyl)sulfonyl]ethyl}thio}ethanol, o-chlorobenzoate")
| SpectraBase Compound ID | 4qS8yhdaU5X |
|---|---|
| InChI | InChI=1S/C17H16Cl2O4S2/c18-13-5-7-14(8-6-13)25(21,22)12-11-24-10-9-23-17(20)15-3-1-2-4-16(15)19/h1-8H,9-12H2 |
| InChIKey | VNRCUHJLXQVNSG-UHFFFAOYSA-N |
| Mol Weight | 419.34 g/mol |
| Molecular Formula | C17H16Cl2O4S2 |
| Exact Mass | 417.986707 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7EpMfvRykV7 |
|---|---|
| Name | 2-{{2-[(p-chlorophenyl)sulfonyl]ethyl}thio}ethanol, o-chlorobenzoate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H16Cl2O4S2 |
| InChI | InChI=1S/C17H16Cl2O4S2/c18-13-5-7-14(8-6-13)25(21,22)12-11-24-10-9-23-17(20)15-3-1-2-4-16(15)19/h1-8H,9-12H2 |
| InChIKey | VNRCUHJLXQVNSG-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55796M |
| Solvent | CDCl3 |