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(2R)-Tricarbonyl(3-methyl-5-phenyl-2,4-pentadienyl-1-acetate)iron

View entire compound with spectra: 1 MS (GC)

(2R)-Tricarbonyl(3-methyl-5-phenyl-2,4-pentadienyl-1-acetate)iron
SpectraBase Compound ID 8qc4uPn8xGU
InChI InChI=1S/C14H16O2.3CO.Fe/c1-12(10-11-16-13(2)15)8-9-14-6-4-3-5-7-14;3*1-2;/h3-10H,11H2,1-2H3;;;;/b9-8+,12-10+;;;;
InChIKey NDFZFFRGAWBAOD-JSTYVVENSA-N
Mol Weight 356.155 g/mol
Molecular Formula C17H16FeO5
Exact Mass 356.03471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5aBWAvarmW
Name (2R)-Tricarbonyl(3-methyl-5-phenyl-2,4-pentadienyl-1-acetate)iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16FeO5
InChI InChI=1S/C14H16O2.3CO.Fe/c1-12(10-11-16-13(2)15)8-9-14-6-4-3-5-7-14;3*1-2;/h3-10H,11H2,1-2H3;;;;/b9-8+,12-10+;;;;
InChIKey NDFZFFRGAWBAOD-JSTYVVENSA-N
Molecular Weight 356.155 g/mol
SMILES c1(\C=C\C(=C\COC(=O)C)C)ccccc1.C([Fe](C#[O])C#[O])#[O]
SPLASH splash10-0udi-0009000000-ce37a9865e325fb719f1
Source of Spectrum QC-5-1680-14
Wiley ID 883752