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Iron, tricarbonyl(.eta.4-7-methyl-3-methylene-1,6-octadiene)-
SpectraBase Compound ID 5oJq92tYS5m
InChI InChI=1S/C10H16.3CO.Fe/c1-5-10(4)8-6-7-9(2)3;3*1-2;/h5,8H,1,4,6-7H2,2-3H3;;;;
InChIKey BBTGQAGSKMEXSH-UHFFFAOYSA-N
Mol Weight 276.11 g/mol
Molecular Formula C13H16FeO3
Exact Mass 276.04488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CzAwVV17snI
Name Iron, tricarbonyl(.eta.4-7-methyl-3-methylene-1,6-octadiene)-
Alternate Name(s) 2-Isohexen-2-yl-1,3-butadiene iron carbonyl complex 5-(buta-1,3-dien-2-yl)-1,1,1-tris(hydroxymethyl)-2,2-dimethyl-1-ferracyclopentane
CAS Registry Number 33434-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16FeO3
InChI InChI=1S/C10H16.3CO.Fe/c1-5-10(4)8-6-7-9(2)3;3*1-2;/h5,8H,1,4,6-7H2,2-3H3;;;;
InChIKey BBTGQAGSKMEXSH-UHFFFAOYSA-N
Molecular Weight 276.113 g/mol
SMILES C1([Fe](C(CC1)(C)C)(C#[O])(C#[O])C#[O])C(C=C)=C
SPLASH splash10-006x-0920000000-20fac1080edb16c150c2
Source of Spectrum O-3-213-4
Wiley ID 40236