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Tricarbonyl[(1-4-.eta.)-1-phenylthio-1,3-cyclohexadiene]iron(0)
SpectraBase Compound ID E9m36afr2TC
InChI InChI=1S/C12H12S.3CO.Fe/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;3*1-2;/h1-5,7-9H,6,10H2;;;;
InChIKey BXNQEPQREVFNSS-UHFFFAOYSA-N
Mol Weight 328.16 g/mol
Molecular Formula C15H12FeO3S
Exact Mass 327.985651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFDa6aOK2qz
Name Tricarbonyl[(1-4-.eta.)-1-phenylthio-1,3-cyclohexadiene]iron(0)
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12FeO3S
InChI InChI=1S/C12H12S.3CO.Fe/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;3*1-2;/h1-5,7-9H,6,10H2;;;;
InChIKey BXNQEPQREVFNSS-UHFFFAOYSA-N
Molecular Weight 328.163 g/mol
SMILES C12([Fe]34(C(CC2)C4C13)(C#[O])(C#[O])C#[O])Sc1ccccc1
SPLASH splash10-0f6x-0093000000-54a3cd344f841d7a70f9
Source of Spectrum QA-43-358-2
Wiley ID 862275