![Methyl 1-[(3-cyanophenyl)methyl]indazole-3-carboxylate](/api/spectrum/2C4yb4CKpmU/structure.png?h=300&w=458 "Methyl 1-[(3-cyanophenyl)methyl]indazole-3-carboxylate")
| SpectraBase Compound ID | 3upzFMgDqQt |
|---|---|
| InChI | InChI=1S/C17H13N3O2/c1-22-17(21)16-14-7-2-3-8-15(14)20(19-16)11-13-6-4-5-12(9-13)10-18/h2-9H,11H2,1H3 |
| InChIKey | RVAIGJBKLMHHNQ-UHFFFAOYSA-N |
| Mol Weight | 291.31 g/mol |
| Molecular Formula | C17H13N3O2 |
| Exact Mass | 291.100777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2C4yb4CKpmU |
|---|---|
| Name | Methyl 1-[(3-cyanophenyl)methyl]indazole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.100776669 u |
| Formula | C17H13N3O2 |
| InChI | InChI=1S/C17H13N3O2/c1-22-17(21)16-14-7-2-3-8-15(14)20(19-16)11-13-6-4-5-12(9-13)10-18/h2-9H,11H2,1H3 |
| InChIKey | RVAIGJBKLMHHNQ-UHFFFAOYSA-N |
| SMILES | C1(=NN(CC2=CC(C#N)=CC=C2)C=2C=CC=CC12)C(=O)OC |