| SpectraBase Compound ID | 5YZxzA4fPlM |
|---|---|
| InChI | InChI=1S/C22H20N2/c23-17-20(16-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)24-21-14-8-3-9-15-21/h1-15,20,22,24H,16H2 |
| InChIKey | TWGYGIAXGNNUSY-UHFFFAOYSA-N |
| Mol Weight | 312.42 g/mol |
| Molecular Formula | C22H20N2 |
| Exact Mass | 312.162649 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 96b6mVTwPms |
|---|---|
| Name | 2-Benzyl-3-phenyl-3-phenylamino-propionitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.162648652 u |
| Formula | C22H20N2 |
| InChI | InChI=1S/C22H20N2/c23-17-20(16-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)24-21-14-8-3-9-15-21/h1-15,20,22,24H,16H2 |
| InChIKey | TWGYGIAXGNNUSY-UHFFFAOYSA-N |
| Molecular Weight | 312.416 g/mol |
| SMILES | C1=CC=CC=C1CC(C(C=1C=CC=CC1)NC1=CC=CC=C1)C#N |