![5-chloro-alpha-[(dimethylamino)methylene]benzo[b]thiophene-3-acetonitrile](/api/spectrum/IiN9PnwKGS3/structure.png?h=300&w=458 "5-chloro-alpha-[(dimethylamino)methylene]benzo[b]thiophene-3-acetonitrile")
| SpectraBase Compound ID | A5TyhIM4E7n |
|---|---|
| InChI | InChI=1S/C13H11ClN2S/c1-16(2)7-9(6-15)12-8-17-13-4-3-10(14)5-11(12)13/h3-5,7-8H,1-2H3 |
| InChIKey | KJHYUKQLLZAWJS-UHFFFAOYSA-N |
| Mol Weight | 262.76 g/mol |
| Molecular Formula | C13H11ClN2S |
| Exact Mass | 262.033147 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IiN9PnwKGS3 |
|---|---|
| Name | 5-chloro-alpha-[(dimethylamino)methylene]benzo[b]thiophene-3-acetonitrile |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H11ClN2S |
| InChI | InChI=1S/C13H11ClN2S/c1-16(2)7-9(6-15)12-8-17-13-4-3-10(14)5-11(12)13/h3-5,7-8H,1-2H3 |
| InChIKey | KJHYUKQLLZAWJS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57364M |
| Solvent | CDCl3 |