| SpectraBase Compound ID | 32Kj1o9Z6SQ |
|---|---|
| InChI | InChI=1S/C8H7F3S2/c9-8(10,11)13-12-6-7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | ZTIUTZSEOLMZIW-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C8H7F3S2 |
| Exact Mass | 223.994127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3k21kdu7xNG |
|---|---|
| Name | Benzyl-trifluoromethyl-disulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.994127062 u |
| Formula | C8H7F3S2 |
| InChI | InChI=1S/C8H7F3S2/c9-8(10,11)13-12-6-7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | ZTIUTZSEOLMZIW-UHFFFAOYSA-N |
| Molecular Weight | 224.259 g/mol |
| SMILES | C(F)(F)(F)SSCC1=CC=CC=C1 |