| SpectraBase Spectrum ID |
9YXwMNf9sYY |
| Name |
Ethyl (E)-3'-[(1.alpha.,2S*,4.alpha.,8S*)-8-Formyl-2,4-dimethoxy-8-methyl-3-oxobicyclo[2.2.2]oct-5-en-2-yl]acrylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22O6 |
| InChI |
InChI=1S/C17H22O6/c1-5-23-13(19)7-8-16(21-3)12-6-9-17(22-4,14(16)20)15(2,10-12)11-18/h6-9,11-12H,5,10H2,1-4H3/b8-7+/t12-,15+,16-,17+/m0/s1 |
| InChIKey |
GEGFPESXDVLLOP-SGWHUFJSSA-N |
| Molecular Weight |
322.357 g/mol |
| SMILES |
[C@@]12(C([C@@](\C=C\C(=O)OCC)(OC)[C@](C=C2)([H])C[C@@]1(C=O)C)=O)OC |
| SPLASH |
splash10-001i-0090000000-ac084e3d2f9d71cf1a5d |
| Source of Spectrum |
KC-0-571-9 |
| Synonyms |
ethyl (2E)-3-[(1R,2S,4S,8S)-8-formyl-2,4-dimethoxy-8-methyl-3-oxobicyclo[2.2.2]oct-5-en-2-yl]-2-propenoate |
| Wiley ID |
787469 |
![Ethyl (E)-3'-[(1.alpha.,2S*,4.alpha.,8S*)-8-Formyl-2,4-dimethoxy-8-methyl-3-oxobicyclo[2.2.2]oct-5-en-2-yl]acrylate](/api/spectrum/9YXwMNf9sYY/structure.png?h=300&w=458 "Ethyl (E)-3'-[(1.alpha.,2S*,4.alpha.,8S*)-8-Formyl-2,4-dimethoxy-8-methyl-3-oxobicyclo[2.2.2]oct-5-en-2-yl]acrylate")
