| SpectraBase Compound ID | ERqqIQ4Beqk |
|---|---|
| InChI | InChI=1S/C30H46O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h8-9,21-24H,1,10-19H2,2-7H3/b9-8+/t21-,22-,23-,24?,27+,28-,29+,30-/m0/s1 |
| InChIKey | ZFWLTWOZGSIECZ-HBSLBWBQSA-N |
| Mol Weight | 422.7 g/mol |
| Molecular Formula | C30H46O |
| Exact Mass | 422.354866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ba3PNfnJI9A |
|---|---|
| Name | CYCLOARTA-23,25-DIEN-3-ONE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O |
| InChI | InChI=1S/C30H46O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h8-9,21-24H,1,10-19H2,2-7H3/b9-8+/t21-,22-,23-,24?,27+,28-,29+,30-/m0/s1 |
| InChIKey | ZFWLTWOZGSIECZ-HBSLBWBQSA-N |
| Literature Reference Author | J.H.G.LAGO,C.B.BROCHINI,N.F.ROQUE |
| Literature Reference Citation | PHYTOCHEM.,55,727(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00302-2 |
| Molecular Weight | 422.695 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU2587 |