| SpectraBase Compound ID | JtR6saQtIrp |
|---|---|
| InChI | InChI=1S/C22H20S2/c1-4-11-19(12-5-1)13-10-18-22(23-20-14-6-2-7-15-20)24-21-16-8-3-9-17-21/h1-9,11-12,14-18H,10,13H2 |
| InChIKey | SOPGZPRMLVREMO-UHFFFAOYSA-N |
| Mol Weight | 348.52 g/mol |
| Molecular Formula | C22H20S2 |
| Exact Mass | 348.100643 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 | Ag9NO1cXadU |
|---|---|
| Name | 4-Phenyl-1,1-bis(phenylthio)-1-butene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.100642992 u |
| Formula | C22H20S2 |
| InChI | InChI=1S/C22H20S2/c1-4-11-19(12-5-1)13-10-18-22(23-20-14-6-2-7-15-20)24-21-16-8-3-9-17-21/h1-9,11-12,14-18H,10,13H2 |
| InChIKey | SOPGZPRMLVREMO-UHFFFAOYSA-N |
| Molecular Weight | 348.522 g/mol |
| SMILES | C(SC1=CC=CC=C1)(SC=1C=CC=CC1)=CCCC=1C=CC=CC1 |