| SpectraBase Compound ID | HECoCXJsNvs |
|---|---|
| InChI | InChI=1S/C21H36O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,16-18H,7-13H2,1-6H3/b15-14+/t16-,17-,18?,21+/m0/s1 |
| InChIKey | KUFCXCJOXPZWCV-LRVGPXMSSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C21H36O2 |
| Exact Mass | 320.27153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HDP12SxQXHO |
|---|---|
| Name | METHYL-LABD-13E-EN-15-OATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O2 |
| InChI | InChI=1S/C21H36O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,16-18H,7-13H2,1-6H3/b15-14+/t16-,17-,18?,21+/m0/s1 |
| InChIKey | KUFCXCJOXPZWCV-LRVGPXMSSA-N |
| Literature Reference Author | P.P.MEBE |
| Literature Reference Citation | PHYTOCHEM.,57,537(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00068-1 |
| Molecular Weight | 320.516 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN2267 |