| SpectraBase Compound ID | HZ7jClcRXtY |
|---|---|
| InChI | InChI=1S/C20H21NO3/c1-11-8-14-13-9-16(22-4)17(23-5)10-15(13)21-18(14)12-6-7-20(2,3)24-19(11)12/h6-10,21H,1-5H3 |
| InChIKey | IUZVYLWUISSZCS-UHFFFAOYSA-N |
| Mol Weight | 323.39 g/mol |
| Molecular Formula | C20H21NO3 |
| Exact Mass | 323.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2fvnDIZ2EYO |
|---|---|
| Name | Koenigicine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.152143537 u |
| Formula | C20H21NO3 |
| InChI | InChI=1S/C20H21NO3/c1-11-8-14-13-9-16(22-4)17(23-5)10-15(13)21-18(14)12-6-7-20(2,3)24-19(11)12/h6-10,21H,1-5H3 |
| InChIKey | IUZVYLWUISSZCS-UHFFFAOYSA-N |
| Molecular Weight | 323.392 g/mol |
| SMILES | COC=1C(OC)=CC=2NC=3C4=C(C(C)=CC3C2C1)OC(C)(C)C=C4 |