| SpectraBase Compound ID | InU7dDHay1E |
|---|---|
| InChI | InChI=1S/C17H14N2O2/c1-12-6-5-9-14(10-12)17(20)18-16-11-15(19-21-16)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,20) |
| InChIKey | ASAUYOCXDOKXRG-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 | 5CTXuo35szd |
|---|---|
| Name | Benzamide, 3-methyl-N-(3-phenyl-5-isoxazolyl)- |
| 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/c1-12-6-5-9-14(10-12)17(20)18-16-11-15(19-21-16)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,20) |
| InChIKey | ASAUYOCXDOKXRG-UHFFFAOYSA-N |
| Molecular Weight | 278.311 g/mol |
| SMILES | N(C1=CC(C2=CC=CC=C2)=NO1)C(C=1C=C(C)C=CC1)=O |