![2-{{[4-(4-chloro-3-nitrophenyl)-2-thiazolyl]methyl}thio}-5-(methylthio)-1,3,4-thiadiazole](/api/spectrum/4FFJZtZcHsp/structure.png?h=300&w=458 "2-{{[4-(4-chloro-3-nitrophenyl)-2-thiazolyl]methyl}thio}-5-(methylthio)-1,3,4-thiadiazole")
| SpectraBase Compound ID | Ds94de0OPCy |
|---|---|
| InChI | InChI=1S/C13H9ClN4O2S4/c1-21-12-16-17-13(24-12)23-6-11-15-9(5-22-11)7-2-3-8(14)10(4-7)18(19)20/h2-5H,6H2,1H3 |
| InChIKey | DCPXIODOKGLPIE-UHFFFAOYSA-N |
| Mol Weight | 416.9 g/mol |
| Molecular Formula | C13H9ClN4O2S4 |
| Exact Mass | 415.929688 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4FFJZtZcHsp |
|---|---|
| Name | 2-{{[4-(4-chloro-3-nitrophenyl)-2-thiazolyl]methyl}thio}-5-(methylthio)-1,3,4-thiadiazole |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H9ClN4O2S4 |
| InChI | InChI=1S/C13H9ClN4O2S4/c1-21-12-16-17-13(24-12)23-6-11-15-9(5-22-11)7-2-3-8(14)10(4-7)18(19)20/h2-5H,6H2,1H3 |
| InChIKey | DCPXIODOKGLPIE-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57450M |
| Solvent | CDCl3 |