| SpectraBase Compound ID | 635R6jWjCOi |
|---|---|
| InChI | InChI=1S/C14H12N2O/c1-17-12-7-5-11(6-8-12)13(10-15)14-4-2-3-9-16-14/h2-9,13H,1H3 |
| InChIKey | QDMAFCQMTITPDU-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C14H12N2O |
| Exact Mass | 224.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HHLz09Nnexa |
|---|---|
| Name | 2-Pyridineacetonitrile, .alpha.-(4-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.094963013 u |
| Formula | C14H12N2O |
| InChI | InChI=1S/C14H12N2O/c1-17-12-7-5-11(6-8-12)13(10-15)14-4-2-3-9-16-14/h2-9,13H,1H3 |
| InChIKey | QDMAFCQMTITPDU-UHFFFAOYSA-N |
| Molecular Weight | 224.263 g/mol |
| SMILES | C(#N)C(C1=NC=CC=C1)C1=CC=C(OC)C=C1 |