| SpectraBase Spectrum ID |
6rG1CDidl0m |
| Name |
benzyl-(1S,6R)-2-oxospiro[bicyclo[4.2.0]octane-7,1'-cyclohexane]-6-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O3 |
| InChI |
InChI=1S/C21H26O3/c22-18-10-7-13-21(17(18)14-20(21)11-5-2-6-12-20)19(23)24-15-16-8-3-1-4-9-16/h1,3-4,8-9,17H,2,5-7,10-15H2/t17-,21+/m1/s1 |
| InChIKey |
DKAKXQJAPAVVOX-UTKZUKDTSA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202000720 |
| Molecular Weight |
326.436 g/mol |
| Reported Formula |
C21H26O3 |
| SMILES |
c1cc(ccc1)COC([C@]12[C@](CC11CCCCC1)(C(CCC2)=O)[H])=O |
| SPLASH |
splash10-0006-9130000000-55f772715af3985b411c |
| Sample Comments |
17% ee, er = 58:42 |
| Source of Spectrum |
QE-26-SM36-S10 |
| Thin-Layer Chromatography |
Rf = 0.29 (P/Et2O, 2:1) |
| Wiley ID |
1858668 |
![benzyl-(1S,6R)-2-oxospiro[bicyclo[4.2.0]octane-7,1'-cyclohexane]-6-carboxylate](/api/spectrum/6rG1CDidl0m/structure.png?h=300&w=458 "benzyl-(1S,6R)-2-oxospiro[bicyclo[4.2.0]octane-7,1'-cyclohexane]-6-carboxylate")
