| SpectraBase Compound ID | BrepUlCKTy3 |
|---|---|
| InChI | InChI=1S/C21H28O8/c1-11(22)25-7-14-8-26-19(29-13(3)24)18-16(14)17-15(5-6-21(18)10-28-21)20(17,4)9-27-12(2)23/h8,15-19H,5-7,9-10H2,1-4H3/t15?,16-,17?,18+,19-,20+,21-/m1/s1 |
| InChIKey | JHVOFEZRFCOCHL-ZXRGHPMRSA-N |
| Mol Weight | 408.45 g/mol |
| Molecular Formula | C21H28O8 |
| Exact Mass | 408.178418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LCJVOk1sqPQ |
|---|---|
| Name | PLAGIOCHILINE-R |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O8 |
| InChI | InChI=1S/C21H28O8/c1-11(22)25-7-14-8-26-19(29-13(3)24)18-16(14)17-15(5-6-21(18)10-28-21)20(17,4)9-27-12(2)23/h8,15-19H,5-7,9-10H2,1-4H3/t15?,16-,17?,18+,19-,20+,21-/m1/s1 |
| InChIKey | JHVOFEZRFCOCHL-ZXRGHPMRSA-N |
| Literature Reference Author | S.VALCIC,J.ZAPP,H.BECKER |
| Literature Reference Citation | PHYTOCHEM.,44,89(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00407-4 |
| Molecular Weight | 408.449 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPA8 |