| SpectraBase Compound ID | 3G25BuacAHh |
|---|---|
| InChI | InChI=1S/C5H9F3S2/c1-2-3-4-9-10-5(6,7)8/h2-4H2,1H3 |
| InChIKey | ZEJJFPQLUGVSIA-UHFFFAOYSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C5H9F3S2 |
| Exact Mass | 190.009777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 28zEtV6i7et |
|---|---|
| Name | Trifluoromethyl butyl disulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.009777127 u |
| Formula | C5H9F3S2 |
| InChI | InChI=1S/C5H9F3S2/c1-2-3-4-9-10-5(6,7)8/h2-4H2,1H3 |
| InChIKey | ZEJJFPQLUGVSIA-UHFFFAOYSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(SSC(F)(F)F)CCC |