| SpectraBase Compound ID | FO11wLFIT8L |
|---|---|
| InChI | InChI=1S/C2H2ClF3S/c3-1-7-2(4,5)6/h1H2 |
| InChIKey | CQQRPMWQQUKPMR-UHFFFAOYSA-N |
| Mol Weight | 150.55 g/mol |
| Molecular Formula | C2H2ClF3S |
| Exact Mass | 149.951783 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HOJglpeP0By |
|---|---|
| Name | Chloromethyl trifluoromethyl sulfide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 149.951783427 u |
| Formula | C2H2ClF3S |
| InChI | InChI=1S/C2H2ClF3S/c3-1-7-2(4,5)6/h1H2 |
| InChIKey | CQQRPMWQQUKPMR-UHFFFAOYSA-N |
| Molecular Weight | 150.546 g/mol |
| SMILES | C(F)(F)(F)SCCl |
| Spectrum/Structure Validation Score (Raman) | 0.909981 |