| SpectraBase Compound ID | EVUwHcWkEO1 |
|---|---|
| InChI | InChI=1S/C20H33BrO/c1-7-19(5,22)12-10-15-14(2)8-9-16-18(3,4)17(21)11-13-20(15,16)6/h7,15-17,22H,1-2,8-13H2,3-6H3/t15-,16-,17-,19?,20+/m1/s1 |
| InChIKey | OOTTXHPHVJPZLE-PAWUTWRLSA-N |
| Mol Weight | 369.4 g/mol |
| Molecular Formula | C20H33BrO |
| Exact Mass | 368.171479 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3OlogFKqBCj |
|---|---|
| Name | ISOPINNATOL-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H33BrO |
| InChI | InChI=1S/C20H33BrO/c1-7-19(5,22)12-10-15-14(2)8-9-16-18(3,4)17(21)11-13-20(15,16)6/h7,15-17,22H,1-2,8-13H2,3-6H3/t15-,16-,17-,19?,20+/m1/s1 |
| InChIKey | OOTTXHPHVJPZLE-PAWUTWRLSA-N |
| Literature Reference Author | M.WESSELS,G.M.KOENIG,A.D.WRIGHT |
| Literature Reference Citation | J.NAT.PROD.,63,920(2000) |
| Literature Reference DOI | 10.1021/np9905721 |
| Molecular Weight | 369.385 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU8535 |