| SpectraBase Compound ID | FoyAlA2GwtQ |
|---|---|
| InChI | InChI=1S/C22H16N2O2/c23-13-19-11-21(25-15-17-7-3-1-4-8-17)22(12-20(19)14-24)26-16-18-9-5-2-6-10-18/h1-12H,15-16H2 |
| InChIKey | GKXPEJISVXRJBA-UHFFFAOYSA-N |
| Mol Weight | 340.38 g/mol |
| Molecular Formula | C22H16N2O2 |
| Exact Mass | 340.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3EW5XAeb9ru |
|---|---|
| Name | 4,5-bis(Benzyloxy)phthalonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.121177761 u |
| Formula | C22H16N2O2 |
| InChI | InChI=1S/C22H16N2O2/c23-13-19-11-21(25-15-17-7-3-1-4-8-17)22(12-20(19)14-24)26-16-18-9-5-2-6-10-18/h1-12H,15-16H2 |
| InChIKey | GKXPEJISVXRJBA-UHFFFAOYSA-N |
| Molecular Weight | 340.382 g/mol |
| SMILES | C(C=1C(C#N)=CC(=C(C1)OCC=1C=CC=CC1)OCC=1C=CC=CC1)#N |