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Ferrocene, 1,1'-diacetyl-2,2'-(1,3-propanediyl)-
SpectraBase Compound ID CM16hqHx3vg
InChI InChI=1S/C17H18O2.Fe/c1-12(18)16-10-4-8-14(16)6-3-7-15-9-5-11-17(15)13(2)19;/h4-5,8-11H,3,6-7H2,1-2H3;/q-10;
InChIKey MWFYDRXSRXUITN-UHFFFAOYSA-N
Mol Weight 310.174 g/mol
Molecular Formula C17H18FeO2
Exact Mass 310.065616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WFSbeAHBYU
Name Ferrocene, 1,1'-diacetyl-2,2'-(1,3-propanediyl)-
Alternate Name(s) 1-Acetyl-2-[3-(2-acetylcyclopentane-1,2,3,4,5-pentaid-1-yl)propyl]cyclopentane-1,2,3,4,5-pentaide iron 2,5'-Diacetyl(3)ferrocenophane
CAS Registry Number 41558-91-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18FeO2
InChI InChI=1S/C17H18O2.Fe/c1-12(18)16-10-4-8-14(16)6-3-7-15-9-5-11-17(15)13(2)19;/h4-5,8-11H,3,6-7H2,1-2H3;/q-10;
InChIKey MWFYDRXSRXUITN-UHFFFAOYSA-N
Molecular Weight 310.174 g/mol
SMILES CC(=O)[C-]1[CH-][CH-][CH-][C-]1CCC[C-]1[CH-][CH-][CH-][C-]1C(C)=O.[Fe]
SPLASH splash10-03di-0129000000-2aecc28e7e4e99f30e87
Source of Spectrum O-6-1280-3
Wiley ID 46155