| SpectraBase Compound ID | 3ZcWD98Ro4U |
|---|---|
| InChI | InChI=1S/C16H20BrNO2S2/c1-10-8-12(15(20)14(17)11(10)2)13(19)9-22-16(21)18-6-4-3-5-7-18/h8,20H,3-7,9H2,1-2H3 |
| InChIKey | PGDRKEKQMUJSAW-UHFFFAOYSA-N |
| Mol Weight | 402.37 g/mol |
| Molecular Formula | C16H20BrNO2S2 |
| Exact Mass | 401.011884 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2YFDPCxMDea |
|---|---|
| Name | 3'-bromo-4',5'-dimethyl-2'-hydroxy-2-mercaptoacetophenone, 2-(1-piperidinecarbodithioate) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H20BrNO2S2 |
| InChI | InChI=1S/C16H20BrNO2S2/c1-10-8-12(15(20)14(17)11(10)2)13(19)9-22-16(21)18-6-4-3-5-7-18/h8,20H,3-7,9H2,1-2H3 |
| InChIKey | PGDRKEKQMUJSAW-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61360M |
| Solvent | CDCl3 |