| SpectraBase Compound ID | 5qIxVYDSMiH |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-17-9-5-15-18(2)7-4-8-19(3,16(21)22)14(18)6-10-20(15,13-17)12-11-17/h14-15H,4-13H2,1-3H3,(H,21,22) |
| InChIKey | VHAZSZJVOSGWCB-UHFFFAOYSA-N |
| Mol Weight | 304.5 g/mol |
| Molecular Formula | C20H32O2 |
| Exact Mass | 304.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4gBYFejK7kK |
|---|---|
| Name | Desoxyisosteviol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.240230268 u |
| Formula | C20H32O2 |
| InChI | InChI=1S/C20H32O2/c1-17-9-5-15-18(2)7-4-8-19(3,16(21)22)14(18)6-10-20(15,13-17)12-11-17/h14-15H,4-13H2,1-3H3,(H,21,22) |
| InChIKey | VHAZSZJVOSGWCB-UHFFFAOYSA-N |
| Molecular Weight | 304.474 g/mol |
| SMILES | C1CCC2(C(C1(C)C(O)=O)CCC13C2CCC(C3)(C)CC1)C |