acetic acid [(1S,3R,3aS,4R,5S,6aS)-5-hexyl-6-keto-3-methylol-4-phenyl-2,3,3a,4,5,6a-hexahydro-1H-pentalen-1-yl]methyl ester
Compound with spectra: 1 NMR
![acetic acid [(1S,3R,3aS,4R,5S,6aS)-5-hexyl-6-keto-3-methylol-4-phenyl-2,3,3a,4,5,6a-hexahydro-1H-pentalen-1-yl]methyl ester](/api/compound/P9imdFE5Y5.png?ph=true&h=300&w=458 "acetic acid [(1S,3R,3aS,4R,5S,6aS)-5-hexyl-6-keto-3-methylol-4-phenyl-2,3,3a,4,5,6a-hexahydro-1H-pentalen-1-yl]methyl ester")
| SpectraBase Compound ID | P9imdFE5Y5 |
|---|---|
| InChI | InChI=1S/C24H34O4/c1-3-4-5-9-12-20-21(17-10-7-6-8-11-17)22-18(14-25)13-19(15-28-16(2)26)23(22)24(20)27/h6-8,10-11,18-23,25H,3-5,9,12-15H2,1-2H3/t18-,19+,20-,21-,22+,23+/m0/s1 |
| InChIKey | QSMDBEFIZPGCPI-BRXKOZLESA-N |
| Mol Weight | 386.5 g/mol |
| Molecular Formula | C24H34O4 |
| Exact Mass | 386.24571 g/mol |
| Enantiomer InChIKey | QSMDBEFIZPGCPI-AJIIZAQNSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
acetic acid [(1S,3R,3aS,4R,5S,6aS)-5-amyl-6-keto-3-methylol-4-phenyl-2,3,3a,4,5,6a-hexahydro-1H-pentalen-1-yl]methyl ester
[4-Hydroxymethyl-2-pentyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
acetic acid [(1S,3R,3aS,4R,5S,6aS)-5-butyl-6-keto-3-methylol-4-phenyl-2,3,3a,4,5,6a-hexahydro-1H-pentalen-1-yl]methyl ester
[4-Hydroxymethyl-2-butyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
[4-Hydroxymethyl-2-propyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
acetic acid [(1S,3R,3aS,4R,5S,6aS)-6-keto-3-methylol-4-phenyl-5-propyl-2,3,3a,4,5,6a-hexahydro-1H-pentalen-1-yl]methyl ester
[6-Hydroxymethyl-2-hexyl-3-phenyl-1-oxooctahydropentalen-4-yl]methyl acetate
[6-Hydroxymethyl-2-butyl-3-phenyl-1-oxooctahydropentalen-4-yl]methyl acetate
[6-Hydroxymethyl-2-propyl-3-phenyl-1-oxooctahydropentalen-4-yl]methyl acetate
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis of Highly Functionalized Pentalenes via IntermolecularPauson–Khand Reaction | European Journal of Organic Chemistry | 2006 |