| SpectraBase Compound ID | 8iBedIVy2s0 |
|---|---|
| InChI | InChI=1S/C19H19NO6/c1-3-25-18-10-6-13(11-19(18)26-4-2)5-8-16(21)15-12-14(20(23)24)7-9-17(15)22/h5-12,22H,3-4H2,1-2H3 |
| InChIKey | WEFUXAGSFXVWBB-UHFFFAOYSA-N |
| Mol Weight | 357.36 g/mol |
| Molecular Formula | C19H19NO6 |
| Exact Mass | 357.121237 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A3Iz3FswTXf |
|---|---|
| Name | 3,4-Diethoxy-2'-hydroxy-5'-nitrochalcone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.121237330 u |
| Formula | C19H19NO6 |
| InChI | InChI=1S/C19H19NO6/c1-3-25-18-10-6-13(11-19(18)26-4-2)5-8-16(21)15-12-14(20(23)24)7-9-17(15)22/h5-12,22H,3-4H2,1-2H3 |
| InChIKey | WEFUXAGSFXVWBB-UHFFFAOYSA-N |
| Molecular Weight | 357.362 g/mol |
| SMILES | OC1=C(C=C(C=C1)N(=O)=O)C(=O)C=CC1=CC(=C(C=C1)OCC)OCC |