| SpectraBase Compound ID | GdhjJ7Fc7hD |
|---|---|
| InChI | InChI=1S/C2F3NS/c3-2(4,5)7-1-6 |
| InChIKey | IWJODGXJDSWIHQ-UHFFFAOYSA-N |
| Mol Weight | 127.08 g/mol |
| Molecular Formula | C2F3NS |
| Exact Mass | 126.970355 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | J3RCA5eTV3X |
|---|---|
| Name | Trifluoromethylthiocyanate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.970354667 u |
| Formula | C2F3NS |
| InChI | InChI=1S/C2F3NS/c3-2(4,5)7-1-6 |
| InChIKey | IWJODGXJDSWIHQ-UHFFFAOYSA-N |
| Molecular Weight | 127.084 g/mol |
| SMILES | C(SC(F)(F)F)#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.905083 |