![3-[(4-chloro-2,5-xylyl)thio]-1-(3-methylbenzo[b]thien-2-yl)-1-propanone](/api/spectrum/4HfACTTPJMY/structure.png?h=300&w=458 "3-[(4-chloro-2,5-xylyl)thio]-1-(3-methylbenzo[b]thien-2-yl)-1-propanone")
| SpectraBase Compound ID | G6MgrJAcuXa |
|---|---|
| InChI | InChI=1S/C20H19ClOS2/c1-12-11-19(13(2)10-16(12)21)23-9-8-17(22)20-14(3)15-6-4-5-7-18(15)24-20/h4-7,10-11H,8-9H2,1-3H3 |
| InChIKey | IMBMIXSECWVAOD-UHFFFAOYSA-N |
| Mol Weight | 374.94 g/mol |
| Molecular Formula | C20H19ClOS2 |
| Exact Mass | 374.056585 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4HfACTTPJMY |
|---|---|
| Name | 3-[(4-chloro-2,5-xylyl)thio]-1-(3-methylbenzo[b]thien-2-yl)-1-propanone |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H19ClOS2 |
| InChI | InChI=1S/C20H19ClOS2/c1-12-11-19(13(2)10-16(12)21)23-9-8-17(22)20-14(3)15-6-4-5-7-18(15)24-20/h4-7,10-11H,8-9H2,1-3H3 |
| InChIKey | IMBMIXSECWVAOD-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56171M |
| Solvent | CDCl3 |