![5-chloro-3-methylbenzo[b]thien-2-yl {{5-[(2-propynyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl ketone](/api/spectrum/BH0Wp7D8JDC/structure.png?h=300&w=458 "5-chloro-3-methylbenzo[b]thien-2-yl {{5-[(2-propynyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl ketone")
| SpectraBase Compound ID | 5wumoN7Ylok |
|---|---|
| InChI | InChI=1S/C16H11ClN2OS4/c1-3-6-21-15-18-19-16(24-15)22-8-12(20)14-9(2)11-7-10(17)4-5-13(11)23-14/h1,4-5,7H,6,8H2,2H3 |
| InChIKey | BLJTYKVZBNSZGF-UHFFFAOYSA-N |
| Mol Weight | 411.0 g/mol |
| Molecular Formula | C16H11ClN2OS4 |
| Exact Mass | 409.944275 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BH0Wp7D8JDC |
|---|---|
| Name | 5-chloro-3-methylbenzo[b]thien-2-yl {{5-[(2-propynyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl ketone |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H11ClN2OS4 |
| InChI | InChI=1S/C16H11ClN2OS4/c1-3-6-21-15-18-19-16(24-15)22-8-12(20)14-9(2)11-7-10(17)4-5-13(11)23-14/h1,4-5,7H,6,8H2,2H3 |
| InChIKey | BLJTYKVZBNSZGF-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 59049M |
| Solvent | CDCl3 |