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(3E)-Tricarbonyl[(3,6-.eta.4)-2,5-dimethyl-2-ethylhexa-3,5-dienal]iron(0)
SpectraBase Compound ID 87Se2qOxVhc
InChI InChI=1S/C10H16O.3CO.Fe/c1-5-10(4,8-11)7-6-9(2)3;3*1-2;/h6-8H,2,5H2,1,3-4H3;;;;/q;3*+1;
InChIKey YDRQSOIQHDGVLB-UHFFFAOYSA-N
Mol Weight 292.11 g/mol
Molecular Formula C13H16FeO4
Exact Mass 292.039795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 518mR7LukRs
Name (3E)-Tricarbonyl[(3,6-.eta.4)-2,5-dimethyl-2-ethylhexa-3,5-dienal]iron(0)
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16FeO4
InChI InChI=1S/C10H16O.3CO.Fe/c1-5-10(4,8-11)7-6-9(2)3;3*1-2;/h6-8H,2,5H2,1,3-4H3;;;;/q;3*+1;
InChIKey YDRQSOIQHDGVLB-UHFFFAOYSA-N
Molecular Weight 292.112 g/mol
SMILES [C@@]12([Fe]3(C2)([C@]1([C@]3(C(C=O)(CC)C)[H])[H])(C#[O+])(C#[O+])C#[O+])C
SPLASH splash10-0a4i-0290000000-b3fa5e16be0e14793b58
Source of Spectrum SO-0-664-2
Wiley ID 874488