| SpectraBase Compound ID | 3tHFWrM1Cpo |
|---|---|
| InChI | InChI=1S/C27H34O9/c1-23(2)16-10-17(29)25(4)15(26(16,13-28)18(35-23)11-19(30)32-5)6-8-24(3)20(14-7-9-33-12-14)34-22(31)21-27(24,25)36-21/h7,9,12,15-16,18,20-21,28H,6,8,10-11,13H2,1-5H3/t15-,16-,18-,20-,21+,24-,25-,26+,27+/m0/s1 |
| InChIKey | XCLFXSUTXZKNFU-QGBLDOQRSA-N |
| Mol Weight | 502.6 g/mol |
| Molecular Formula | C27H34O9 |
| Exact Mass | 502.220283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GJGdmV333UZ |
|---|---|
| Name | METHYL-UGUENENOATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O9 |
| InChI | InChI=1S/C27H34O9/c1-23(2)16-10-17(29)25(4)15(26(16,13-28)18(35-23)11-19(30)32-5)6-8-24(3)20(14-7-9-33-12-14)34-22(31)21-27(24,25)36-21/h7,9,12,15-16,18,20-21,28H,6,8,10-11,13H2,1-5H3/t15-,16-,18-,20-,21+,24-,25-,26+,27+/m0/s1 |
| InChIKey | XCLFXSUTXZKNFU-QGBLDOQRSA-N |
| Literature Reference Author | P.K.CHEPLOGOI,D.A.MULHOLLAND,P.H.COOMBES,M.RANDRIANARIVELOJO SIA |
| Literature Reference Citation | PHYTOCHEM.,69,1384(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.12.013 |
| Molecular Weight | 502.562 g/mol |
| Sample ID | 44048 |
| Solvent | CDCl3 |