| SpectraBase Compound ID | KxooYPXKOWW |
|---|---|
| InChI | InChI=1S/C18H13NO5/c1-23-15-3-2-4-16-17(15)18(20)13(11-24-16)8-5-12-6-9-14(10-7-12)19(21)22/h2-11H,1H3/b8-5- |
| InChIKey | AYOUWVKODHZEML-YVMONPNESA-N |
| Mol Weight | 323.3 g/mol |
| Molecular Formula | C18H13NO5 |
| Exact Mass | 323.079373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5v54kmyKo8F |
|---|---|
| Name | (Z)-3-Styryl-4'-nitro-5-methoxychromone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.079372518 u |
| Formula | C18H13NO5 |
| InChI | InChI=1S/C18H13NO5/c1-23-15-3-2-4-16-17(15)18(20)13(11-24-16)8-5-12-6-9-14(10-7-12)19(21)22/h2-11H,1H3/b8-5- |
| InChIKey | AYOUWVKODHZEML-YVMONPNESA-N |
| Molecular Weight | 323.304 g/mol |
| SMILES | C=12C(C(\C=C/C3=CC=C(N(=O)=O)C=C3)=COC1C=CC=C2OC)=O |