SpectraBase Spectrum ID |
4QYuak2iAL5 |
Name |
(3S,4E,6E)-Tricarbonyliron[(.eta.(4)-4-7)-4,6-octadien-3-one] |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H12FeO4 |
InChI |
InChI=1S/C8H12O.3CO.Fe/c1-3-5-6-7-8(9)4-2;3*1-2;/h3,5-7H,4H2,1-2H3;;;; |
InChIKey |
IZAXOYDVVFGMLT-UHFFFAOYSA-N |
Molecular Weight |
264.058 g/mol |
SMILES |
C12[Fe]3(C2C(=O)CC)(C1C3C)(C#[O])(C#[O])C#[O] |
SPLASH |
splash10-066r-0190000000-2e2ef051cca0f76a8be8 |
Source of Spectrum |
F-54-15577-13 |
Synonyms |
1-[1,1,1-tris(hydroxymethyl)-5-methyl-1-ferratricyclo[2.1.0.0(1,3)]pentan-2-yl]propan-1-one |
Wiley ID |
810103 |