SpectraBase Spectrum ID |
DhNQ96zKscN |
Name |
(+-)-(3E)-Tricarbonyl[(3,6-.eta.4)-2,2,5-trimethylhexa-3,5-dienal]iron(0) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H14FeO4 |
InChI |
InChI=1S/C9H14O.3CO.Fe/c1-8(2)5-6-9(3,4)7-10;3*1-2;/h5-7H,1H2,2-4H3;;;;/q;3*+1; |
InChIKey |
APTFKDOHCASUTO-UHFFFAOYSA-N |
Molecular Weight |
278.085 g/mol |
SMILES |
[C@@]12([Fe]3(C2)([C@]1([C@]3(C(C=O)(C)C)[H])[H])(C#[O+])(C#[O+])C#[O+])C |
SPLASH |
splash10-00dl-0940000000-f780a2bdb593f78c0adb |
Source of Spectrum |
SO-0-664-2 |
Wiley ID |
874489 |