![Coumaran-6-ol-3-one, 2-[4-methoxybenzylidene]-](/api/spectrum/1jFjTM82Z94/structure.png?h=300&w=458 "Coumaran-6-ol-3-one, 2-[4-methoxybenzylidene]-")
| SpectraBase Compound ID | 7eXkAvg4yGm |
|---|---|
| InChI | InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)8-15-16(18)13-7-4-11(17)9-14(13)20-15/h2-9,17H,1H3/b15-8- |
| InChIKey | CVEOFOQULTXCSE-NVNXTCNLSA-N |
| Mol Weight | 268.27 g/mol |
| Molecular Formula | C16H12O4 |
| Exact Mass | 268.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1jFjTM82Z94 |
|---|---|
| Name | Coumaran-6-ol-3-one, 2-[4-methoxybenzylidene]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.073558862 u |
| Formula | C16H12O4 |
| InChI | InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)8-15-16(18)13-7-4-11(17)9-14(13)20-15/h2-9,17H,1H3/b15-8- |
| InChIKey | CVEOFOQULTXCSE-NVNXTCNLSA-N |
| SMILES | C12=C(C=C(C=C2)O)O\C(C1=O)=C\C1=CC=C(C=C1)OC |