| SpectraBase Compound ID | GhZ0oMXhtQ5 |
|---|---|
| InChI | InChI=1S/C21H15NS/c1-2-9-17(10-3-1)23-21-13-7-5-11-18(21)20-15-14-16-8-4-6-12-19(16)22-20/h1-15H |
| InChIKey | RYOKTZNJQAJMDI-UHFFFAOYSA-N |
| Mol Weight | 313.42 g/mol |
| Molecular Formula | C21H15NS |
| Exact Mass | 313.092521 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9wYtlzHItYL |
|---|---|
| Name | 2-(2-(Phenylthio)phenyl)quinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.092520661 u |
| Formula | C21H15NS |
| InChI | InChI=1S/C21H15NS/c1-2-9-17(10-3-1)23-21-13-7-5-11-18(21)20-15-14-16-8-4-6-12-19(16)22-20/h1-15H |
| InChIKey | RYOKTZNJQAJMDI-UHFFFAOYSA-N |
| Molecular Weight | 313.418 g/mol |
| SMILES | C1(=NC2=CC=CC=C2C=C1)C=1C(=CC=CC1)SC=1C=CC=CC1 |