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(3S,4S,4E,6E)-Tricarbonyliron[(.eta.(4)-4-7)-4,6-octadien-3-ol]
SpectraBase Compound ID FNGOA25wuxa
InChI InChI=1S/C8H14O.3CO.Fe/c1-3-5-6-7-8(9)4-2;3*1-2;/h3,5-9H,4H2,1-2H3;;;;/t8-;;;;/m0..../s1
InChIKey DOPUAJPKFVTXDJ-USHJOAKVSA-N
Mol Weight 266.07 g/mol
Molecular Formula C11H14FeO4
Exact Mass 266.024145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXrKgYvNfda
Name (3S,4S,4E,6E)-Tricarbonyliron[(.eta.(4)-4-7)-4,6-octadien-3-ol]
Alternate Name(s) (3S,4R,4E,6E)-Tricarbonyliron[(.eta.(4)-4-7)-4,6-octadien-3-ol] (1S)-1-[1,1,1-tris(hydroxymethyl)-5-methyl-1-ferratricyclo[2.1.0.0(1,3)]pentan-2-yl]propan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14FeO4
InChI InChI=1S/C8H14O.3CO.Fe/c1-3-5-6-7-8(9)4-2;3*1-2;/h3,5-9H,4H2,1-2H3;;;;/t8-;;;;/m0..../s1
InChIKey DOPUAJPKFVTXDJ-USHJOAKVSA-N
Molecular Weight 266.074 g/mol
SMILES O[C@](C1[Fe]23(C1C3C2C)(C#[O])(C#[O])C#[O])(CC)[H]
SPLASH splash10-0btj-0690000000-ee54efbe28436d2335d7
Source of Spectrum F-54-15577-12
Wiley ID 810104