| SpectraBase Compound ID | IVWs5OpuMvO |
|---|---|
| InChI | InChI=1S/C20H28N2O2/c1-3-4-5-6-7-8-12-15-21-20(23)18-16(2)24-22-19(18)17-13-10-9-11-14-17/h9-11,13-14H,3-8,12,15H2,1-2H3,(H,21,23) |
| InChIKey | GGKXXEZXRWJPQJ-UHFFFAOYSA-N |
| Mol Weight | 328.46 g/mol |
| Molecular Formula | C20H28N2O2 |
| Exact Mass | 328.215078 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FS3gv3Ukmpk |
|---|---|
| Name | 5-Methyl-N-nonyl-3-phenyl-4-isoxazolecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.215078148 u |
| Formula | C20H28N2O2 |
| InChI | InChI=1S/C20H28N2O2/c1-3-4-5-6-7-8-12-15-21-20(23)18-16(2)24-22-19(18)17-13-10-9-11-14-17/h9-11,13-14H,3-8,12,15H2,1-2H3,(H,21,23) |
| InChIKey | GGKXXEZXRWJPQJ-UHFFFAOYSA-N |
| SMILES | N(C(C=1C(=NOC1C)C1=CC=CC=C1)=O)CCCCCCCCC |