| SpectraBase Compound ID | J1R9Hz8XiO4 |
|---|---|
| InChI | InChI=1S/C15H12N2O/c16-9-12-5-7-13(8-6-12)10-17-11-14-3-1-2-4-15(14)18/h1-8,11,18H,10H2/b17-11+ |
| InChIKey | QYJNNDGCCBEHPS-GZTJUZNOSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C15H12N2O |
| Exact Mass | 236.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E3ttCYpxgJh |
|---|---|
| Name | alpha-(Salicylideneamino)-p-tolunitrile |
| 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/c16-9-12-5-7-13(8-6-12)10-17-11-14-3-1-2-4-15(14)18/h1-8,11,18H,10H2/b17-11+ |
| InChIKey | QYJNNDGCCBEHPS-GZTJUZNOSA-N |
| Molecular Weight | 236.274 g/mol |
| SMILES | OC1=C(C=CC=C1)\C=N\CC=1C=CC(=CC1)C#N |