| SpectraBase Compound ID | EjBiNEq4MzF |
|---|---|
| InChI | InChI=1S/C16H15NO5/c1-2-21-16-9-12(10-18)6-7-15(16)22-11-13-4-3-5-14(8-13)17(19)20/h3-10H,2,11H2,1H3 |
| InChIKey | ANROAHNVADLJOO-UHFFFAOYSA-N |
| Mol Weight | 301.3 g/mol |
| Molecular Formula | C16H15NO5 |
| Exact Mass | 301.095023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EomSKaSc7jX |
|---|---|
| Name | Benzaldehyde, 3-ethoxy-4-(3-nitrobenzyloxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.095022582 u |
| Formula | C16H15NO5 |
| InChI | InChI=1S/C16H15NO5/c1-2-21-16-9-12(10-18)6-7-15(16)22-11-13-4-3-5-14(8-13)17(19)20/h3-10H,2,11H2,1H3 |
| InChIKey | ANROAHNVADLJOO-UHFFFAOYSA-N |
| SMILES | CCOC1=C(OCC=2C=C(N(=O)=O)C=CC2)C=CC(=C1)C=O |