| SpectraBase Spectrum ID |
4CYA1NxAWW |
| Name |
(1R*,2R*,4S*)-1-(5,5-Dimethyl-1,3-dioxan-2-yl)-5,5-dimethoxy-6-oxobicyclo[2.2.2]octane-2-carbaldehyde |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.172938551 u |
| Formula |
C17H26O6 |
| InChI |
InChI=1S/C17H26O6/c1-15(2)9-22-14(23-10-15)16-6-5-11(7-12(16)8-18)17(20-3,21-4)13(16)19/h8,11-12,14H,5-7,9-10H2,1-4H3/t11-,12-,16-/m0/s1 |
| InChIKey |
ZGWLZDZZXGPJHP-MKBNYLNASA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800806 |
| Molecular Weight |
326.389 g/mol |
| Quality |
147 |
| Reported Formula |
C17H26O6 |
| SMILES |
[C@]1([C@]2(CC[C@@](C1)(C(C2=O)(OC)OC)[H])C1OCC(CO1)(C)C)(C=O)[H] |
| SPLASH |
splash10-0gb9-0980000000-c2a4fd56a877ab512504 |
| Source of Spectrum |
K1-2018-4692-11 (DOI: 10.1002/ejoc.201800806) |
| Wiley ID |
1894262 |
![(1R*,2R*,4S*)-1-(5,5-Dimethyl-1,3-dioxan-2-yl)-5,5-dimethoxy-6-oxobicyclo[2.2.2]octane-2-carbaldehyde](/api/spectrum/4CYA1NxAWW/structure.png?h=300&w=458 "(1R*,2R*,4S*)-1-(5,5-Dimethyl-1,3-dioxan-2-yl)-5,5-dimethoxy-6-oxobicyclo[2.2.2]octane-2-carbaldehyde")
