| SpectraBase Compound ID | C28sSzlJ49B |
|---|---|
| InChI | InChI=1S/C14H8N2O/c15-9-10-5-1-2-6-11(10)14-16-12-7-3-4-8-13(12)17-14/h1-8H |
| InChIKey | AKFAWVJVWNTLGE-UHFFFAOYSA-N |
| Mol Weight | 220.23 g/mol |
| Molecular Formula | C14H8N2O |
| Exact Mass | 220.063663 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4QmNyvr0QvW |
|---|---|
| Name | 2-(Benzoxazol-2'-yl)benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.063662885 u |
| Formula | C14H8N2O |
| InChI | InChI=1S/C14H8N2O/c15-9-10-5-1-2-6-11(10)14-16-12-7-3-4-8-13(12)17-14/h1-8H |
| InChIKey | AKFAWVJVWNTLGE-UHFFFAOYSA-N |
| Molecular Weight | 220.231 g/mol |
| SMILES | C1(=NC2=CC=CC=C2O1)C=1C(C#N)=CC=CC1 |