For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ferrocene, [2-(methoxycarbonyl)phenyl]-
SpectraBase Compound ID 4bqDXodxu6
InChI InChI=1S/C13H11O2.C5H5.Fe/c1-15-13(14)12-8-4-7-11(9-12)10-5-2-3-6-10;1-2-4-5-3-1;/h2-9H,1H3;1-5H;/q2*-5;
InChIKey FWJPVGBIGQICAO-UHFFFAOYSA-N
Mol Weight 320.17 g/mol
Molecular Formula C18H16FeO2
Exact Mass 320.049966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HWJTZxRs9bn
Name Ferrocene, [2-(methoxycarbonyl)phenyl]-
CAS Registry Number 1294-22-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16FeO2
InChI InChI=1S/C13H11O2.C5H5.Fe/c1-15-13(14)12-8-4-7-11(9-12)10-5-2-3-6-10;1-2-4-5-3-1;/h2-9H,1H3;1-5H;/q2*-5;
InChIKey FWJPVGBIGQICAO-UHFFFAOYSA-N
Molecular Weight 320.169 g/mol
SMILES COC(=O)c1cccc(c1)[C-]1[CH-][CH-][CH-][CH-]1.[Fe].[CH-]1[CH-][CH-][CH-][CH-]1
SPLASH splash10-05fr-0297000000-c0172d598ac9025b2289
Source of Spectrum AD-0-5494-0
Synonyms 1-[3-(methoxycarbonyl)phenyl]cyclopentane-1,2,3,4,5-pentaide cyclopentane-1,2,3,4,5-pentaide iron Methyl 2-ferrocenylbenzoate
Wiley ID 1320089