| SpectraBase Compound ID | 3Xta5AapR0F |
|---|---|
| InChI | InChI=1S/C21H18N2O/c1-16-9-8-14-19(15-16)22-20(17-10-4-2-5-11-17)21(23-24)18-12-6-3-7-13-18/h2-15,24H,1H3/b22-20-,23-21+ |
| InChIKey | PDCWCYKCPFQIKL-KEEJTVGESA-N |
| Mol Weight | 314.39 g/mol |
| Molecular Formula | C21H18N2O |
| Exact Mass | 314.141913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B22SDki9Uws |
|---|---|
| Name | Benzil .alpha.-(3-methylphenyl)imino oxime |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.141913207 u |
| Formula | C21H18N2O |
| InChI | InChI=1S/C21H18N2O/c1-16-9-8-14-19(15-16)22-20(17-10-4-2-5-11-17)21(23-24)18-12-6-3-7-13-18/h2-15,24H,1H3/b22-20-,23-21+ |
| InChIKey | PDCWCYKCPFQIKL-KEEJTVGESA-N |
| Molecular Weight | 314.388 g/mol |
| SMILES | C1(\C(\C(=N/C=2C=C(C)C=CC2)C2=CC=CC=C2)=N\O)=CC=CC=C1 |