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(4RS,5RS)-(Z)-Tricarbonyl[5,8.eta.-4-methyl-1,5,7-octadien-4-ol]iron
SpectraBase Compound ID 5cOV55Mx0hg
InChI InChI=1S/C9H14O.3CO.Fe/c1-4-6-8-9(3,10)7-5-2;3*1-2;/h4-6,8,10H,1-2,7H2,3H3;;;;/t9-;;;;/m1..../s1
InChIKey WTLQHDASZBWOHL-RASHCQHBSA-N
Mol Weight 278.09 g/mol
Molecular Formula C12H14FeO4
Exact Mass 278.024145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bjBjziXZkU
Name (4RS,5RS)-(Z)-Tricarbonyl[5,8.eta.-4-methyl-1,5,7-octadien-4-ol]iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14FeO4
InChI InChI=1S/C9H14O.3CO.Fe/c1-4-6-8-9(3,10)7-5-2;3*1-2;/h4-6,8,10H,1-2,7H2,3H3;;;;/t9-;;;;/m1..../s1
InChIKey WTLQHDASZBWOHL-RASHCQHBSA-N
Molecular Weight 278.085 g/mol
SMILES O[C@]1([C@@]2([Fe]3([C@@]2(C=C)[H])([C@](C1)(C3)[H])(C#[O])(C#[O])C#[O])[H])C
SPLASH splash10-0007-0920000000-5ba43c6234f03ffc43a4
Source of Spectrum E1-44-945-4
Synonyms (4RS,5RS)-(E)-Tricarbonyl[5-8.eta.-4-methyl-1,5,7-octatriene-4-ol]iron
Wiley ID 1553445