| SpectraBase Compound ID | 5JCQbKgd8Xh |
|---|---|
| InChI | InChI=1S/C15H11ClN2O/c16-13-8-4-5-11(9-13)10-14-17-18-15(19-14)12-6-2-1-3-7-12/h1-9H,10H2 |
| InChIKey | ZHDSXYYEQNUSPQ-UHFFFAOYSA-N |
| Mol Weight | 270.72 g/mol |
| Molecular Formula | C15H11ClN2O |
| Exact Mass | 270.055991 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9QG1bM34wdQ |
|---|---|
| Name | 2-(3-Chlorobenzyl)-5-phenyl-1,3,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.055990681 u |
| Formula | C15H11ClN2O |
| InChI | InChI=1S/C15H11ClN2O/c16-13-8-4-5-11(9-13)10-14-17-18-15(19-14)12-6-2-1-3-7-12/h1-9H,10H2 |
| InChIKey | ZHDSXYYEQNUSPQ-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=CC1)C1=NN=C(O1)CC=1C=C(Cl)C=CC1 |