| SpectraBase Compound ID | BRNc6UIoGVo |
|---|---|
| InChI | InChI=1S/C21H20O5/c1-12(2)4-9-15-19(25-3)11-17(24)20-16(23)10-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10-11,22,24H,9H2,1-3H3 |
| InChIKey | BSZYNZDGUZYMDL-UHFFFAOYSA-N |
| Mol Weight | 352.39 g/mol |
| Molecular Formula | C21H20O5 |
| Exact Mass | 352.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CFL0sq2RHoi |
|---|---|
| Name | Artonin U |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.131073739 u |
| Formula | C21H20O5 |
| InChI | InChI=1S/C21H20O5/c1-12(2)4-9-15-19(25-3)11-17(24)20-16(23)10-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10-11,22,24H,9H2,1-3H3 |
| InChIKey | BSZYNZDGUZYMDL-UHFFFAOYSA-N |
| Molecular Weight | 352.386 g/mol |
| SMILES | C12=C(C(=O)C=C(O2)C2=CC=C(C=C2)O)C(O)=CC(=C1CC=C(C)C)OC |