| SpectraBase Compound ID | JBbCp4g9bCc |
|---|---|
| InChI | InChI=1S/C16H10N4O2/c17-9-10-5-7-11(8-6-10)14-15(19-20-18-14)16(22)12-3-1-2-4-13(12)21/h1-8,21H,(H,18,19,20) |
| InChIKey | ILAIBGXUVIAGEN-UHFFFAOYSA-N |
| Mol Weight | 290.28 g/mol |
| Molecular Formula | C16H10N4O2 |
| Exact Mass | 290.080376 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BaTkLb292Nd |
|---|---|
| Name | 4-(4-Cyanophenyl)-5-(2-hydroxybenzoyl)-1,2,3 -triazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.080375576 u |
| Formula | C16H10N4O2 |
| InChI | InChI=1S/C16H10N4O2/c17-9-10-5-7-11(8-6-10)14-15(19-20-18-14)16(22)12-3-1-2-4-13(12)21/h1-8,21H,(H,18,19,20) |
| InChIKey | ILAIBGXUVIAGEN-UHFFFAOYSA-N |
| Molecular Weight | 290.282 g/mol |
| SMILES | C1(=C(N=NN1)C1=CC=C(C#N)C=C1)C(C=1C(O)=CC=CC1)=O |