| SpectraBase Compound ID | LWXiUwWxcmo |
|---|---|
| InChI | InChI=1S/C20H20O3/c1-20(2)13-12-16-18(22)11-9-15(19(16)23-20)17(21)10-8-14-6-4-3-5-7-14/h3-11,22H,12-13H2,1-2H3/b10-8+ |
| InChIKey | AFQZHNGSACUUEK-CSKARUKUSA-N |
| Mol Weight | 308.38 g/mol |
| Molecular Formula | C20H20O3 |
| Exact Mass | 308.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9hneSFg6LEh |
|---|---|
| Name | 8-Cinnamoyl-5-hydroxy-2,2-dimethylchroman |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.141244501 u |
| Formula | C20H20O3 |
| InChI | InChI=1S/C20H20O3/c1-20(2)13-12-16-18(22)11-9-15(19(16)23-20)17(21)10-8-14-6-4-3-5-7-14/h3-11,22H,12-13H2,1-2H3/b10-8+ |
| InChIKey | AFQZHNGSACUUEK-CSKARUKUSA-N |
| Molecular Weight | 308.377 g/mol |
| SMILES | C=12C(C(\C=C\C3=CC=CC=C3)=O)=CC=C(C1CCC(O2)(C)C)O |