| SpectraBase Compound ID | 6nIaJqzMXzQ |
|---|---|
| InChI | InChI=1S/C5H6N2O2S/c1-4(7(8)9)5(2)10-3-6/h1-2H3/b5-4- |
| InChIKey | HEIFTGCIQPAZMG-PLNGDYQASA-N |
| Mol Weight | 158.17 g/mol |
| Molecular Formula | C5H6N2O2S |
| Exact Mass | 158.014999 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7sOrEZuHd7E |
|---|---|
| Name | (Z)-2-Thiocyanato-3-nitro-2-butene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H6N2O2S |
| InChI | InChI=1S/C5H6N2O2S/c1-4(7(8)9)5(2)10-3-6/h1-2H3/b5-4- |
| InChIKey | HEIFTGCIQPAZMG-PLNGDYQASA-N |
| Molecular Weight | 158.175 g/mol |
| SMILES | C(S\C(=C\(N(=O)=O)C)C)#N |
| SPLASH | splash10-0zfr-9000000000-e13ae3f0c04933852e0d |
| Source of Spectrum | AJ-63-3008-0 |
| Synonyms | (1Z)-1-methyl-2-nitro-1-propenyl thiocyanate |
| Wiley ID | 1154898 |