| SpectraBase Compound ID | 3cET61nqra1 |
|---|---|
| InChI | InChI=1S/C15H14OS3/c16-19-15(17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey | UVOLJHWLOLEPBJ-UHFFFAOYSA-N |
| Mol Weight | 306.46 g/mol |
| Molecular Formula | C15H14OS3 |
| Exact Mass | 306.020679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9B193waQOQ8 |
|---|---|
| Name | 1,1-bis(Phenylmethylthio)-1-sulfinylmethane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.020678592 u |
| Formula | C15H14OS3 |
| InChI | InChI=1S/C15H14OS3/c16-19-15(17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey | UVOLJHWLOLEPBJ-UHFFFAOYSA-N |
| Molecular Weight | 306.456 g/mol |
| SMILES | C(=S=O)(SCC=1C=CC=CC1)SCC=1C=CC=CC1 |