![N-[1,1'-Biphenyl]-2-yl-5-methyl-3-isoxazolecarboxamide](/api/spectrum/Gs9FRV594HE/structure.png?h=300&w=458 "N-[1,1'-Biphenyl]-2-yl-5-methyl-3-isoxazolecarboxamide")
| SpectraBase Compound ID | Gc5ToYklKy1 |
|---|---|
| InChI | InChI=1S/C17H14N2O2/c1-12-11-16(19-21-12)17(20)18-15-10-6-5-9-14(15)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,20) |
| InChIKey | KFJJOVARXGKNFZ-UHFFFAOYSA-N |
| Mol Weight | 278.31 g/mol |
| Molecular Formula | C17H14N2O2 |
| Exact Mass | 278.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gs9FRV594HE |
|---|---|
| Name | N-[1,1'-Biphenyl]-2-yl-5-methyl-3-isoxazolecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.105527697 u |
| Formula | C17H14N2O2 |
| InChI | InChI=1S/C17H14N2O2/c1-12-11-16(19-21-12)17(20)18-15-10-6-5-9-14(15)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,20) |
| InChIKey | KFJJOVARXGKNFZ-UHFFFAOYSA-N |
| SMILES | C(NC1=C(C=CC=C1)C1=CC=CC=C1)(=O)C1=NOC(=C1)C |