![4-(5-chloro-3-methylbenzo[b]thien-2-yl)-2-[(2-propynyl)thio]pyrimidine](/api/spectrum/Jnmli14kYIQ/structure.png?h=300&w=458 "4-(5-chloro-3-methylbenzo[b]thien-2-yl)-2-[(2-propynyl)thio]pyrimidine")
| SpectraBase Compound ID | 27sDvKtBJfa |
|---|---|
| InChI | InChI=1S/C16H11ClN2S2/c1-3-8-20-16-18-7-6-13(19-16)15-10(2)12-9-11(17)4-5-14(12)21-15/h1,4-7,9H,8H2,2H3 |
| InChIKey | HBKSPPWYCNDJRB-UHFFFAOYSA-N |
| Mol Weight | 330.85 g/mol |
| Molecular Formula | C16H11ClN2S2 |
| Exact Mass | 330.005218 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jnmli14kYIQ |
|---|---|
| Name | 4-(5-chloro-3-methylbenzo[b]thien-2-yl)-2-[(2-propynyl)thio]pyrimidine |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H11ClN2S2 |
| InChI | InChI=1S/C16H11ClN2S2/c1-3-8-20-16-18-7-6-13(19-16)15-10(2)12-9-11(17)4-5-14(12)21-15/h1,4-7,9H,8H2,2H3 |
| InChIKey | HBKSPPWYCNDJRB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58412M |
| Solvent | CDCl3 |