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(4S*,5R*,8S*)-[(5,8-.eta.)-4-Hydroxy-trans-5,trans-7-nona-1,5,7-triene]tricarbonyliron complex
SpectraBase Compound ID BIGQsYbOAFJ
InChI InChI=1S/C9H14O.3CO.Fe/c1-3-5-6-8-9(10)7-4-2;3*1-2;/h3-6,8-10H,2,7H2,1H3;;;;
InChIKey XIIXMHXYINROMY-UHFFFAOYSA-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 43KnlIqtU
Name (4S*,5R*,8S*)-[(5,8-.eta.)-4-Hydroxy-trans-5,trans-7-nona-1,5,7-triene]tricarbonyliron complex
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14FeO4
InChI InChI=1S/C9H14O.3CO.Fe/c1-3-5-6-8-9(10)7-4-2;3*1-2;/h3-6,8-10H,2,7H2,1H3;;;;
InChIKey XIIXMHXYINROMY-UHFFFAOYSA-N
Molecular Weight 278.085 g/mol
SMILES OC(C1[Fe]23(C1C3C2C)(C#[O])(C#[O])C#[O])CC=C
SPLASH splash10-00bd-4920000000-179075de332b324a004b
Source of Spectrum QA-41-136-6
Wiley ID 861842