| SpectraBase Compound ID | CJ563aCtZbH |
|---|---|
| InChI | InChI=1S/C22H17NO/c1-23(20-13-6-3-7-14-20)22(24)17-16-19-12-8-9-15-21(19)18-10-4-2-5-11-18/h2-15H,1H3 |
| InChIKey | VCPRVKMHWPNQBH-UHFFFAOYSA-N |
| Mol Weight | 311.38 g/mol |
| Molecular Formula | C22H17NO |
| Exact Mass | 311.131014 g/mol |
| SpectraBase Spectrum ID | BGS7YPsQhOk |
|---|---|
| Name | 3-([1,1'-Biphenyl]-2-yl)-N-methyl-N-phenylpropiolamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.131014170 u |
| Formula | C22H17NO |
| InChI | InChI=1S/C22H17NO/c1-23(20-13-6-3-7-14-20)22(24)17-16-19-12-8-9-15-21(19)18-10-4-2-5-11-18/h2-15H,1H3 |
| InChIKey | VCPRVKMHWPNQBH-UHFFFAOYSA-N |
| SMILES | C(C#CC=1C(=CC=CC1)C=1C=CC=CC1)(=O)N(C=1C=CC=CC1)C |