Iron, 1,3,5-octatriene tricarbonyl-

SpectraBase Compound ID	9ABCHtpQemn
InChI	InChI=1S/C8H12.3CO.Fe/c1-3-5-7-8-6-4-2;31-2;/h3,5-8H,1,4H2,2H3;;;;/q;3+1;
InChIKey	FCENITSWSFLQPC-UHFFFAOYSA-N Google Search
Mol Weight	248.06 g/mol
Molecular Formula	C11H12FeO3
Exact Mass	248.01358 g/mol

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SpectraBase Spectrum ID	Axx2nxGQ7Zd
Name	Iron, 1,3,5-octatriene tricarbonyl-
CAS Registry Number	69526-38-1
Comments	Structure changed after expert review
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C11H12FeO3
InChI	InChI=1S/C8H12.3CO.Fe/c1-3-5-7-8-6-4-2;31-2;/h3,5-8H,1,4H2,2H3;;;;/q;3+1;
InChIKey	FCENITSWSFLQPC-UHFFFAOYSA-N
Molecular Weight	248.059 g/mol
SMILES	C12C(C=C)[Fe]22(C(C12)CC)(C#[O+])(C#[O+])C#[O+]
SPLASH	splash10-03fr-6910000000-9e537ae62ad4fb8c9a30
Source of Spectrum	HE-1982-0-0
Wiley ID	1250597