![5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, o-chlorobenzoate](/api/spectrum/KLJ7yjtivQx/structure.png?h=300&w=458 "5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, o-chlorobenzoate")
| SpectraBase Compound ID | 5wHblLnY7O8 |
|---|---|
| InChI | InChI=1S/C18H12Cl2O3S/c1-10-13-8-11(19)6-7-16(13)24-17(10)15(21)9-23-18(22)12-4-2-3-5-14(12)20/h2-8H,9H2,1H3 |
| InChIKey | VDGUAWZGMVSYFL-UHFFFAOYSA-N |
| Mol Weight | 379.26 g/mol |
| Molecular Formula | C18H12Cl2O3S |
| Exact Mass | 377.988421 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KLJ7yjtivQx |
|---|---|
| Name | 5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, o-chlorobenzoate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H12Cl2O3S |
| InChI | InChI=1S/C18H12Cl2O3S/c1-10-13-8-11(19)6-7-16(13)24-17(10)15(21)9-23-18(22)12-4-2-3-5-14(12)20/h2-8H,9H2,1H3 |
| InChIKey | VDGUAWZGMVSYFL-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55813M |
| Solvent | CDCl3 |