| SpectraBase Compound ID | C8iZjs9ltXx |
|---|---|
| InChI | InChI=1S/C9H4N4O2S/c10-5-8-11-12-9(16-8)6-1-3-7(4-2-6)13(14)15/h1-4H |
| InChIKey | DGMXJGPRIOHCOT-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 | FBFBL4wVgmB |
|---|---|
| Name | 5-(4-nitrophenyl)-1,3,4-thiadiazole-2-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H4N4O2S |
| InChI | InChI=1S/C9H4N4O2S/c10-5-8-11-12-9(16-8)6-1-3-7(4-2-6)13(14)15/h1-4H |
| InChIKey | DGMXJGPRIOHCOT-UHFFFAOYSA-N |
| Molecular Weight | 232.217 g/mol |
| SMILES | c1(sc(nn1)C#N)-c1ccc(cc1)N(=O)=O |
| SPLASH | splash10-0gb9-0950000000-3883f9abe2b5f8007b60 |
| Source of Spectrum | K-2002-1545-9 |
| Wiley ID | 1612847 |