| SpectraBase Compound ID | K24bjbUOBPB |
|---|---|
| InChI | InChI=1S/C14H10BrN3O/c15-11-8-6-10(7-9-11)13-17-18-14(19-13)16-12-4-2-1-3-5-12/h1-9H,(H,16,18) |
| InChIKey | ZFNNHAOHMWOMCJ-UHFFFAOYSA-N |
| Mol Weight | 316.16 g/mol |
| Molecular Formula | C14H10BrN3O |
| Exact Mass | 315.000725 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BhbwWeqVASj |
|---|---|
| Name | 2-(4-Bromophenyl)-5-(phenylamino)-1,3,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.000724953 u |
| Formula | C14H10BrN3O |
| InChI | InChI=1S/C14H10BrN3O/c15-11-8-6-10(7-9-11)13-17-18-14(19-13)16-12-4-2-1-3-5-12/h1-9H,(H,16,18) |
| InChIKey | ZFNNHAOHMWOMCJ-UHFFFAOYSA-N |
| Molecular Weight | 316.158 g/mol |
| SMILES | C1(=NN=C(O1)NC1=CC=CC=C1)C1=CC=C(Br)C=C1 |