| SpectraBase Compound ID | IrkuWSh1loY |
|---|---|
| InChI | InChI=1S/C21H13N3O2/c22-13-16-7-4-8-17(14-23)20(16)26-19-11-9-18(10-12-19)24-21(25)15-5-2-1-3-6-15/h1-12H,(H,24,25) |
| InChIKey | DBWQAFFPRPRXGL-UHFFFAOYSA-N |
| Mol Weight | 339.35 g/mol |
| Molecular Formula | C21H13N3O2 |
| Exact Mass | 339.100777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ICCUXPUcq7a |
|---|---|
| Name | 4'-(2,6-Dicyanophenoxy)benzanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.100776669 u |
| Formula | C21H13N3O2 |
| InChI | InChI=1S/C21H13N3O2/c22-13-16-7-4-8-17(14-23)20(16)26-19-11-9-18(10-12-19)24-21(25)15-5-2-1-3-6-15/h1-12H,(H,24,25) |
| InChIKey | DBWQAFFPRPRXGL-UHFFFAOYSA-N |
| Molecular Weight | 339.354 g/mol |
| SMILES | N(C=1C=CC(=CC1)OC1=C(C=CC=C1C#N)C#N)C(C=1C=CC=CC1)=O |