| SpectraBase Spectrum ID |
FpITXKnnDsZ |
| Name |
(1S*,2r*,4R*)-5-Bromo-1-(5,5-dimethyl-1,3-dioxan-2-yl)-8,8-dimethoxy-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22BrNO5 |
| InChI |
InChI=1S/C17H22BrNO5/c1-15(2)8-23-14(24-9-15)16-6-12(18)11(5-10(16)7-19)17(21-3,22-4)13(16)20/h6,10-11,14H,5,8-9H2,1-4H3/t10-,11-,16-/m0/s1 |
| InChIKey |
WWALBGHLAVLTLV-MMPTUQATSA-N |
| Molecular Weight |
400.269 g/mol |
| SMILES |
[C@]12(C(C(OC)(OC)[C@](C[C@]2(C#N)[H])([H])C(=C1)Br)=O)C1OCC(CO1)(C)C |
| SPLASH |
splash10-00di-3159000000-d0516b621cd3d38336de |
| Source of Spectrum |
F-59-4045-4d |
| Wiley ID |
1678073 |
![(1S*,2r*,4R*)-5-Bromo-1-(5,5-dimethyl-1,3-dioxan-2-yl)-8,8-dimethoxy-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide](/api/spectrum/FpITXKnnDsZ/structure.png?h=300&w=458 "(1S*,2r*,4R*)-5-Bromo-1-(5,5-dimethyl-1,3-dioxan-2-yl)-8,8-dimethoxy-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide")
