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[(6-9.eta.)-Ethyl 8-methyl-cis-6,8-nonadienoate]tricarbonyliron complex
SpectraBase Compound ID E0RcBWWWWH1
InChI InChI=1S/C12H20O2.3CO.Fe/c1-4-11(3)9-7-6-8-10-12(13)14-5-2;3*1-2;/h4,7,9H,5-6,8,10H2,1-3H3;;;;
InChIKey UDBXMUDLWQKBJB-UHFFFAOYSA-N
Mol Weight 336.17 g/mol
Molecular Formula C15H20FeO5
Exact Mass 336.06601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55GaAy6Z57D
Name [(6-9.eta.)-Ethyl 8-methyl-cis-6,8-nonadienoate]tricarbonyliron complex
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20FeO5
InChI InChI=1S/C12H20O2.3CO.Fe/c1-4-11(3)9-7-6-8-10-12(13)14-5-2;3*1-2;/h4,7,9H,5-6,8,10H2,1-3H3;;;;
InChIKey UDBXMUDLWQKBJB-UHFFFAOYSA-N
Molecular Weight 336.165 g/mol
SMILES [C@@]12([Fe]3(C2C)(C1[C@@]3(CCCC(=O)OCC)[H])(C#[O])(C#[O])C#[O])C
SPLASH splash10-0zfr-5490000000-3b2f0313abcd08069f30
Source of Spectrum C-115-5949-7
Synonyms Ethyl 4-[(2S,4R)-1,1,1-tris(hydroxymethyl)-4,5-dimethyl-1-ferratricyclo[2.1.0.0(1,3)]pentan-2-yl]butanoate
Wiley ID 1332127