| SpectraBase Compound ID | ABcQdUFD5cI |
|---|---|
| InChI | InChI=1S/C24H36O6/c1-4-5-6-7-8-9-11-22(28-17(2)25)23(29-18(3)26)15-14-19-16-20(19)21-12-10-13-24(27)30-21/h8-9,14-15,19-23H,4-7,10-13,16H2,1-3H3/b9-8+,15-14+/t19-,20-,21-,22-,23+/m0/s1 |
| InChIKey | WCUCKKHAMLJYQT-RHGPLZLISA-N |
| Mol Weight | 420.5 g/mol |
| Molecular Formula | C24H36O6 |
| Exact Mass | 420.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9IsIyCnz54P |
|---|---|
| Name | CONSTANOLACTONE-E-PERACETATE |
| Compound Number | 27 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H36O6 |
| InChI | InChI=1S/C24H36O6/c1-4-5-6-7-8-9-11-22(28-17(2)25)23(29-18(3)26)15-14-19-16-20(19)21-12-10-13-24(27)30-21/h8-9,14-15,19-23H,4-7,10-13,16H2,1-3H3/b9-8+,15-14+/t19-,20-,21-,22-,23+/m0/s1 |
| InChIKey | WCUCKKHAMLJYQT-RHGPLZLISA-N |
| Literature Reference Author | D.G.NAGLE,W.H.GERWICK |
| Literature Reference Citation | J.ORG.CHEM.,59,7227(1994) |
| Literature Reference DOI | 10.1021/jo00103a012 |
| Molecular Weight | 420.546 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP7377 |