| SpectraBase Spectrum ID |
Jb4re8c1dqt |
| Name |
(+)-(2S,5R,1'S)-Tricarbonyl[methoxycarbonyl(phenyl)methyl (2,3,4,5-.eta.)hexa-2,4-dienoate]iron |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16FeO7 |
| InChI |
InChI=1S/C15H16O4.3CO.Fe/c1-3-4-6-11-13(16)19-14(15(17)18-2)12-9-7-5-8-10-12;3*1-2;/h3-11,14H,1-2H3;;;;/t14-;;;;/m0..../s1 |
| InChIKey |
FDGMYLGCLWBQQN-XCYGSCDUSA-N |
| Molecular Weight |
400.164 g/mol |
| SMILES |
[C@@]1([Fe]23([C@]1([C@@]3([C@]2(C)[H])[H])[H])(C#[O])(C#[O])C#[O])(C(O[C@](C(=O)OC)(c1ccccc1)[H])=O)[H] |
| SPLASH |
splash10-014i-2819000000-018660689e102db623d2 |
| Source of Spectrum |
KC-0-3489-13 |
| Wiley ID |
826830 |
![(+)-(2S,5R,1'S)-Tricarbonyl[methoxycarbonyl(phenyl)methyl (2,3,4,5-.eta.)hexa-2,4-dienoate]iron](/api/spectrum/Jb4re8c1dqt/structure.png?h=300&w=458 "(+)-(2S,5R,1'S)-Tricarbonyl[methoxycarbonyl(phenyl)methyl (2,3,4,5-.eta.)hexa-2,4-dienoate]iron")
