![5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, 2,4-dichlorobenzoate](/api/spectrum/6QnXA0y8Bvu/structure.png?h=300&w=458 "5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, 2,4-dichlorobenzoate")
| SpectraBase Compound ID | JVvKBIVCuFs |
|---|---|
| InChI | InChI=1S/C18H11Cl3O3S/c1-9-13-6-10(19)3-5-16(13)25-17(9)15(22)8-24-18(23)12-4-2-11(20)7-14(12)21/h2-7H,8H2,1H3 |
| InChIKey | UVZSRIUENWKIMN-UHFFFAOYSA-N |
| Mol Weight | 413.7 g/mol |
| Molecular Formula | C18H11Cl3O3S |
| Exact Mass | 411.949448 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6QnXA0y8Bvu |
|---|---|
| Name | 5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, 2,4-dichlorobenzoate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H11Cl3O3S |
| InChI | InChI=1S/C18H11Cl3O3S/c1-9-13-6-10(19)3-5-16(13)25-17(9)15(22)8-24-18(23)12-4-2-11(20)7-14(12)21/h2-7H,8H2,1H3 |
| InChIKey | UVZSRIUENWKIMN-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55812M |
| Solvent | CDCl3 |