| SpectraBase Compound ID | FvrV5PWLgaI |
|---|---|
| InChI | InChI=1S/C6H4N2S2/c9-5-7-3-1-2-4-8-6-10/h3-4H2 |
| InChIKey | JJTCGJDJOXDENN-UHFFFAOYSA-N |
| Mol Weight | 168.23 g/mol |
| Molecular Formula | C6H4N2S2 |
| Exact Mass | 167.98159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FzsXWYArVxF |
|---|---|
| Name | 1,4-Diisothiocyanato-2-butyne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H4N2S2 |
| InChI | InChI=1S/C6H4N2S2/c9-5-7-3-1-2-4-8-6-10/h3-4H2 |
| InChIKey | JJTCGJDJOXDENN-UHFFFAOYSA-N |
| Molecular Weight | 168.232 g/mol |
| SMILES | C(N=C=S)C#CCN=C=S |
| SPLASH | splash10-0udi-9100000000-15b15f4a1017e0efb1de |
| Source of Spectrum | K1-2001-1096-3 |
| Synonyms | 1,4-Diisothiocyanatobut-2-yne |
| Wiley ID | 846798 |