![N-[2-(Benzylthio)benzylidene]aniline](/api/spectrum/50bkfXl61NH/structure.png?h=300&w=458 "N-[2-(Benzylthio)benzylidene]aniline")
| SpectraBase Compound ID | DEWSBdvq6Ye |
|---|---|
| InChI | InChI=1S/C20H17NS/c1-3-9-17(10-4-1)16-22-20-14-8-7-11-18(20)15-21-19-12-5-2-6-13-19/h1-15H,16H2/b21-15+ |
| InChIKey | TZFSUDRUOSRMRE-RCCKNPSSSA-N |
| Mol Weight | 303.42 g/mol |
| Molecular Formula | C20H17NS |
| Exact Mass | 303.108171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 50bkfXl61NH |
|---|---|
| Name | N-[2-(Benzylthio)benzylidene]aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.108170725 u |
| Formula | C20H17NS |
| InChI | InChI=1S/C20H17NS/c1-3-9-17(10-4-1)16-22-20-14-8-7-11-18(20)15-21-19-12-5-2-6-13-19/h1-15H,16H2/b21-15+ |
| InChIKey | TZFSUDRUOSRMRE-RCCKNPSSSA-N |
| SMILES | C=1(\C=N\C=2C=CC=CC2)C(SCC=2C=CC=CC2)=CC=CC1 |