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Ferrocene, 1-formyl-2-(methoxycarbonyl)-, (R)-
SpectraBase Compound ID AfazIUrpsCG
InChI InChI=1S/C8H7O3.C5H5.Fe/c1-11-8(10)7-4-2-3-6(7)5-9;1-2-4-5-3-1;/h2-5H,1H3;1-5H;/q2*-5;
InChIKey STVJKQDASXAINL-UHFFFAOYSA-N
Mol Weight 272.08 g/mol
Molecular Formula C13H12FeO3
Exact Mass 272.01358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67An1N5aezq
Name Ferrocene, 1-formyl-2-(methoxycarbonyl)-, (R)-
Alternate Name(s) 2-formyl-1-[methoxy(oxo)methane]cyclopentane-1,2,3,4,5-pentaide cyclopentane-1,2,3,4,5-pentaide iron Ferrocene, 1-formyl-2-(methoxycarbonyl)-, stereoisomer Methyl 2-formyl-1-ferrocenecarboxylate
CAS Registry Number 38768-41-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12FeO3
InChI InChI=1S/C8H7O3.C5H5.Fe/c1-11-8(10)7-4-2-3-6(7)5-9;1-2-4-5-3-1;/h2-5H,1H3;1-5H;/q2*-5;
InChIKey STVJKQDASXAINL-UHFFFAOYSA-N
Molecular Weight 272.081 g/mol
SMILES COC(=O)[C-]1[CH-][CH-][CH-][C-]1C=O.[Fe].[CH-]1[CH-][CH-][CH-][CH-]1
SPLASH splash10-00di-1930000000-65ec49096b52824ba708
Source of Spectrum O-20-108-9
Wiley ID 1275826