| SpectraBase Compound ID | 5X1GDa6J193 |
|---|---|
| InChI | InChI=1S/C15H12N2O7/c1-2-23-15-7-10(9-18)3-5-14(15)24-13-6-4-11(16(19)20)8-12(13)17(21)22/h3-9H,2H2,1H3 |
| InChIKey | LGWULEGGQGLJME-UHFFFAOYSA-N |
| Mol Weight | 332.27 g/mol |
| Molecular Formula | C15H12N2O7 |
| Exact Mass | 332.064451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4UdwdWDFHCS |
|---|---|
| Name | 4-(2,4-Dinitrophenoxy)-3-ethoxybenzaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.064450727 u |
| Formula | C15H12N2O7 |
| InChI | InChI=1S/C15H12N2O7/c1-2-23-15-7-10(9-18)3-5-14(15)24-13-6-4-11(16(19)20)8-12(13)17(21)22/h3-9H,2H2,1H3 |
| InChIKey | LGWULEGGQGLJME-UHFFFAOYSA-N |
| Molecular Weight | 332.268 g/mol |
| SMILES | C(OC=1C(=CC=C(C1)C=O)OC1=C(C=C(C=C1)N(=O)=O)N(=O)=O)C |