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(2RS,3SR,6RS,3E,5E)-Tricarbonyl-[.eta(4).-(3->6)-2-hydroxyhepta-3,5-dienenitrile]-iron
SpectraBase Compound ID 2A8STjKtpTb
InChI InChI=1S/C7H9NO.3CO.Fe/c1-2-3-4-5-7(9)6-8;3*1-2;/h2-5,7,9H,1H3;;;;/t7-;;;;/m0..../s1
InChIKey GMBUNIIGUABMJP-HEDVWWMMSA-N
Mol Weight 263.03 g/mol
Molecular Formula C10H9FeNO4
Exact Mass 262.988094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eqhjm5nq5tS
Name (2RS,3SR,6RS,3E,5E)-Tricarbonyl-[.eta(4).-(3->6)-2-hydroxyhepta-3,5-dienenitrile]-iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9FeNO4
InChI InChI=1S/C7H9NO.3CO.Fe/c1-2-3-4-5-7(9)6-8;3*1-2;/h2-5,7,9H,1H3;;;;/t7-;;;;/m0..../s1
InChIKey GMBUNIIGUABMJP-HEDVWWMMSA-N
Molecular Weight 263.030 g/mol
SMILES O[C@@](C1[Fe]23(C1C3C2C)(C#[O])(C#[O])C#[O])(C#N)[H]
SPLASH splash10-0ue9-0910000000-58135decda71bc613701
Source of Spectrum C-121-9149-endo-2
Wiley ID 1700339