| SpectraBase Compound ID | GOhXUek2ZZF |
|---|---|
| InChI | InChI=1S/C9H4N4O2S/c10-4-6-3-7(13(14)15)1-2-8(6)12-9(16)5-11/h1-3H,(H,12,16) |
| InChIKey | QWOKYWWVBANPKT-UHFFFAOYSA-N |
| Mol Weight | 232.22 g/mol |
| Molecular Formula | C9H4N4O2S |
| Exact Mass | 232.005497 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LoMxkyz1ML3 |
|---|---|
| Name | 2-(Cyanothioformamido)-5-nitrobenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H4N4O2S |
| InChI | InChI=1S/C9H4N4O2S/c10-4-6-3-7(13(14)15)1-2-8(6)12-9(16)5-11/h1-3H,(H,12,16) |
| InChIKey | QWOKYWWVBANPKT-UHFFFAOYSA-N |
| Molecular Weight | 232.217 g/mol |
| SMILES | N(C(C#N)=S)c1ccc(N(=O)=O)cc1C#N |
| SPLASH | splash10-0a4i-7980000000-b48ed9afa9bfed1e7f10 |
| Source of Spectrum | F4-41-4170-2c |
| Wiley ID | 1673253 |