| SpectraBase Compound ID | ECgIi6SS8Rx |
|---|---|
| InChI | InChI=1S/C15H12N2O/c16-11-10-12-6-8-14(9-7-12)17-15(18)13-4-2-1-3-5-13/h1-9H,10H2,(H,17,18) |
| InChIKey | INYQOIZENUYTRI-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C15H12N2O |
| Exact Mass | 236.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JooPPDhfk46 |
|---|---|
| Name | Benzamide, N-(4-cyanomethylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.094963013 u |
| Formula | C15H12N2O |
| InChI | InChI=1S/C15H12N2O/c16-11-10-12-6-8-14(9-7-12)17-15(18)13-4-2-1-3-5-13/h1-9H,10H2,(H,17,18) |
| InChIKey | INYQOIZENUYTRI-UHFFFAOYSA-N |
| Molecular Weight | 236.274 g/mol |
| SMILES | C(NC1=CC=C(CC#N)C=C1)(=O)C=1C=CC=CC1 |