![4-pyridinecarboximidamide, N'-[(2-[1,1'-biphenyl]-4-ylacetyl)oxy]-](/api/spectrum/Jq1TCF1H5N5/structure.png?h=300&w=458 "4-pyridinecarboximidamide, N'-[(2-[1,1'-biphenyl]-4-ylacetyl)oxy]-")
| SpectraBase Compound ID | 3a1mAzQ4D2z |
|---|---|
| InChI | InChI=1S/C20H17N3O2/c21-20(18-10-12-22-13-11-18)23-25-19(24)14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-13H,14H2,(H2,21,23) |
| InChIKey | PRKFUFAUXKJWDS-UHFFFAOYSA-N |
| Mol Weight | 331.38 g/mol |
| Molecular Formula | C20H17N3O2 |
| Exact Mass | 331.132077 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jq1TCF1H5N5 |
|---|---|
| Name | 4-Pyridinecarboximidamide, N'-[(2-[1,1'-biphenyl]-4-ylacetyl)oxy]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.132076797 u |
| Formula | C20H17N3O2 |
| InChI | InChI=1S/C20H17N3O2/c21-20(18-10-12-22-13-11-18)23-25-19(24)14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-13H,14H2,(H2,21,23) |
| InChIKey | PRKFUFAUXKJWDS-UHFFFAOYSA-N |
| SMILES | N\C(=N/OC(=O)CC1=CC=C(C=C1)C=1C=CC=CC1)C1=CC=NC=C1 |