| SpectraBase Compound ID | 7GeoeN5nx13 |
|---|---|
| InChI | InChI=1S/C13H9ClN4O/c14-10-4-1-5-11(7-10)16-13-18-17-12(19-13)9-3-2-6-15-8-9/h1-8H,(H,16,18) |
| InChIKey | LIPWSEIRQKTUOU-UHFFFAOYSA-N |
| Mol Weight | 272.69 g/mol |
| Molecular Formula | C13H9ClN4O |
| Exact Mass | 272.046489 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fo7khZCwTVo |
|---|---|
| Name | 2-(3-Pyridyl)-5-(3-chlorophenylamino)-1,3,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.046488625 u |
| Formula | C13H9ClN4O |
| InChI | InChI=1S/C13H9ClN4O/c14-10-4-1-5-11(7-10)16-13-18-17-12(19-13)9-3-2-6-15-8-9/h1-8H,(H,16,18) |
| InChIKey | LIPWSEIRQKTUOU-UHFFFAOYSA-N |
| SMILES | C=1(OC(=NN1)NC=1C=C(C=CC1)Cl)C=1C=NC=CC1 |