| SpectraBase Compound ID | H1CiwHMJ20h |
|---|---|
| InChI | InChI=1S/C16H13N3O3/c20-19(21)14-8-4-7-13(11-14)16-17-15(22-18-16)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2 |
| InChIKey | YVPDFWGUWBVCBF-UHFFFAOYSA-N |
| Mol Weight | 295.3 g/mol |
| Molecular Formula | C16H13N3O3 |
| Exact Mass | 295.095691 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BUGa2Rds3Cw |
|---|---|
| Name | 3-(3-Nitrophenyl)-5-(2-phenylethyl)-1,2,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.095691288 u |
| Formula | C16H13N3O3 |
| InChI | InChI=1S/C16H13N3O3/c20-19(21)14-8-4-7-13(11-14)16-17-15(22-18-16)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2 |
| InChIKey | YVPDFWGUWBVCBF-UHFFFAOYSA-N |
| Molecular Weight | 295.298 g/mol |
| SMILES | C1(=NOC(=N1)CCC1=CC=CC=C1)C1=CC(=CC=C1)N(=O)=O |