| SpectraBase Compound ID | 1mySPmRHP8T |
|---|---|
| InChI | InChI=1S/C20H28O2/c1-13(12-21)6-5-10-19(3)16-8-7-14(2)15-9-11-20(4,22)17(15)18(16)19/h5-6,10,12,15-18,22H,2,7-9,11H2,1,3-4H3/b10-5+,13-6-/t15-,16+,17+,18+,19-,20-/m0/s1 |
| InChIKey | OAIHJXPEYJVLCP-IGDKETGQSA-N |
| Mol Weight | 300.44 g/mol |
| Molecular Formula | C20H28O2 |
| Exact Mass | 300.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KHhTroto6Yt |
|---|---|
| Name | Boscartol F |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.208930140 u |
| Formula | C20H28O2 |
| InChI | InChI=1S/C20H28O2/c1-13(12-21)6-5-10-19(3)16-8-7-14(2)15-9-11-20(4,22)17(15)18(16)19/h5-6,10,12,15-18,22H,2,7-9,11H2,1,3-4H3/b10-5+,13-6-/t15-,16+,17+,18+,19-,20-/m0/s1 |
| InChIKey | OAIHJXPEYJVLCP-IGDKETGQSA-N |
| SMILES | [C@]12([C@@](CC[C@@]2(O)C)(C(=C)CC[C@@]2([C@]1([C@@]2(C)\C=C\C=C\(C)C=O)[H])[H])[H])[H] |