| SpectraBase Spectrum ID |
5nvkylHc5Y1 |
| Name |
(3'S / 3'R)-1'-Oxo-2'-(ethoxycarbonyl)-3'-[(ethoxycarbonyl)methyl]-cyclopenta[4,5-a]ferrocene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22FeO5 |
| InChI |
InChI=1S/C15H17O5.C5H5.Fe/c1-3-19-12(16)8-11-9-6-5-7-10(9)14(17)13(11)15(18)20-4-2;1-2-4-5-3-1;/h5-7,11,13H,3-4,8H2,1-2H3;1-5H;/t11-,13?;;/m0../s1 |
| InChIKey |
MBPYXXCZCVFQRM-VDWHCVNUSA-N |
| Molecular Weight |
398.236 g/mol |
| SMILES |
[C@]123[Fe]456789%10([C@@]2([C@@](C(C1=O)C(=O)OCC)(CC(=O)OCC)[H])[C@@]5([C@@]%10([C@]34[H])[H])[H])[C@]1([C@@]6([C@@]7([C@@]8([C@@]91[H])[H])[H])[H])[H] |
| SPLASH |
splash10-0ff0-0009000000-6f2e0633e8df9d82373d |
| Source of Spectrum |
U1-2009-4435-19b |
| Wiley ID |
1697088 |
![(3'S / 3'R)-1'-Oxo-2'-(ethoxycarbonyl)-3'-[(ethoxycarbonyl)methyl]-cyclopenta[4,5-a]ferrocene](/api/spectrum/5nvkylHc5Y1/structure.png?h=300&w=458 "(3'S / 3'R)-1'-Oxo-2'-(ethoxycarbonyl)-3'-[(ethoxycarbonyl)methyl]-cyclopenta[4,5-a]ferrocene")
