| SpectraBase Spectrum ID |
EJPaBVKjOjL |
| Name |
(2R,5S,6S,2E,4E)-Tricarbonyliron[(.eta.(4)2-5)-6-hydroxyundeca-2,4-dienyl] (S)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetate |
| Alternate Name(s) |
{5-[(1S)-1-hydroxyhexyl]-1,1,1-tris(hydroxymethyl)-1-ferratricyclo[2.1.0.0(1,3)]pentan-2-yl}methyl (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H27F3FeO7 |
| InChI |
InChI=1S/C21H27F3O4.3CO.Fe/c1-3-4-7-14-18(25)15-10-6-11-16-28-19(26)20(27-2,21(22,23)24)17-12-8-5-9-13-17;3*1-2;/h5-6,8-13,15,18,25H,3-4,7,14,16H2,1-2H3;;;;/t18-,20-;;;;/m0..../s1 |
| InChIKey |
ZIRYYWCWIDBSGY-MZRVIGHFSA-N |
| Molecular Weight |
540.313 g/mol |
| SMILES |
O[C@](C1[Fe]23(C(C3COC([C@](C(F)(F)F)(c3ccccc3)OC)=O)C12)(C#[O])(C#[O])C#[O])(CCCCC)[H] |
| SPLASH |
splash10-0udi-0900100000-1603439cefc90785c273 |
| Source of Spectrum |
F-54-15578-2 |
| Wiley ID |
810099 |
![(2R,5S,6S,2E,4E)-Tricarbonyliron[(.eta.(4)2-5)-6-hydroxyundeca-2,4-dienyl] (S)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetate](/api/spectrum/EJPaBVKjOjL/structure.png?h=300&w=458 "(2R,5S,6S,2E,4E)-Tricarbonyliron[(.eta.(4)2-5)-6-hydroxyundeca-2,4-dienyl] (S)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetate")
