| SpectraBase Compound ID | 3w7VkYIBCGY |
|---|---|
| InChI | InChI=1S/C6H6N2S2/c7-5-9-3-1-2-4-10-6-8/h1-2H,3-4H2/b2-1+ |
| InChIKey | SNXCTEZCRLCWSX-OWOJBTEDSA-N |
| Mol Weight | 170.25 g/mol |
| Molecular Formula | C6H6N2S2 |
| Exact Mass | 169.997241 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bn7DmyjBteK |
|---|---|
| Name | 1,4-Dithiocyanato-but-2-ene |
| CAS Registry Number | 5263-52-5 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C6H6N2S2 |
| InChI | InChI=1S/C6H6N2S2/c7-5-9-3-1-2-4-10-6-8/h1-2H,3-4H2/b2-1+ |
| InChIKey | SNXCTEZCRLCWSX-OWOJBTEDSA-N |
| Instrument Name | Bruker AM-360 |
| Literature Reference | E.H. Abd Elall, J.M. Mellor, J. Chem. Soc. Perkin I 2729 (1987). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |