| SpectraBase Compound ID | 71vK8xXIPk4 |
|---|---|
| InChI | InChI=1S/C20H18S2/c1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18/h3-14H,1-2H3 |
| InChIKey | SSUIXBVCVWGZOL-UHFFFAOYSA-N |
| Mol Weight | 322.48 g/mol |
| Molecular Formula | C20H18S2 |
| Exact Mass | 322.084993 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3b3wa22hFKX |
|---|---|
| Name | 1,4-bis(4-Methylphenylthio)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.084992928 u |
| Formula | C20H18S2 |
| InChI | InChI=1S/C20H18S2/c1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18/h3-14H,1-2H3 |
| InChIKey | SSUIXBVCVWGZOL-UHFFFAOYSA-N |
| Molecular Weight | 322.484 g/mol |
| SMILES | C1=CC(=CC=C1SC1=CC=C(C=C1)C)SC1=CC=C(C=C1)C |