| SpectraBase Compound ID | 6kPdn1KwSp6 |
|---|---|
| InChI | InChI=1S/C3H2F3NS/c4-3(5,6)8-2-1-7/h2H2 |
| InChIKey | PHGGITSOPYXTPP-UHFFFAOYSA-N |
| Mol Weight | 141.11 g/mol |
| Molecular Formula | C3H2F3NS |
| Exact Mass | 140.986005 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3gg8Hj4Mnw |
|---|---|
| Name | 2-(Trifluoromethylsulfanyl)acetonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C3H2F3NS |
| InChI | InChI=1S/C3H2F3NS/c4-3(5,6)8-2-1-7/h2H2 |
| InChIKey | PHGGITSOPYXTPP-UHFFFAOYSA-N |
| Molecular Weight | 141.111 g/mol |
| SMILES | C(SCC#N)(F)(F)F |
| SPLASH | splash10-00kg-9400000000-d69c8dbc0cae49c4105b |
| Source of Spectrum | K-127-453-3 |
| Synonyms | 2-(Trifluoromethylsulfanyl)ethanenitrile 2-(Trifluoromethylthio)acetonitrile |
| Wiley ID | 1140052 |