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(4R*,5R*)-[(5,8-.eta.)1-Acetoxy-4-Hhdroxy-trans-5,7-octadiene]tricarbonyliron complex
SpectraBase Compound ID 801rKu01qEh
InChI InChI=1S/C10H16O3.3CO.Fe/c1-3-4-6-10(12)7-5-8-13-9(2)11;3*1-2;/h3-4,6,10,12H,1,5,7-8H2,2H3;;;;/t10-;;;;/m0..../s1
InChIKey ZXMIUXPVEDIBLT-CZEDPBFNSA-N
Mol Weight 324.11 g/mol
Molecular Formula C13H16FeO6
Exact Mass 324.029624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cLr8IBUTme
Name (4R*,5R*)-[(5,8-.eta.)1-Acetoxy-4-Hhdroxy-trans-5,7-octadiene]tricarbonyliron complex
Alternate Name(s) (4R*,5R*)-[(5,8-.eta.)1-Acetoxy-4-Hydroxy-trans-5,7-octadiene]tricarbonyliron complex
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16FeO6
InChI InChI=1S/C10H16O3.3CO.Fe/c1-3-4-6-10(12)7-5-8-13-9(2)11;3*1-2;/h3-4,6,10,12H,1,5,7-8H2,2H3;;;;/t10-;;;;/m0..../s1
InChIKey ZXMIUXPVEDIBLT-CZEDPBFNSA-N
Molecular Weight 324.110 g/mol
SMILES O[C@@](C1[Fe]23(C1C3C2)(C#[O])(C#[O])C#[O])(CCCOC(=O)C)[H]
SPLASH splash10-0036-4990000000-de34453a6e2f6dd98915
Source of Spectrum QA-41-133-3
Wiley ID 861859