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

*Links on SpectraBase are not permalinks.
Carbon monoxide; iron; iron(2+); tetramethyl buta-1,3-diene-1,2,3,4-tetracarboxylate
SpectraBase Compound ID AQPRvw0uf12
InChI InChI=1S/C12H12O8.6CO.2Fe/c1-17-9(13)5-7(11(15)19-3)8(12(16)20-4)6-10(14)18-2;6*1-2;;/h1-4H3;;;;;;;;/q-2;;;;;;;;+2
InChIKey GLAOVNBZQIIEMC-UHFFFAOYSA-N
Mol Weight 563.97 g/mol
Molecular Formula C18H12Fe2O14
Exact Mass 563.892577 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 J1dl00IRLd6
Name Carbon monoxide; iron; iron(2+); tetramethyl buta-1,3-diene-1,2,3,4-tetracarboxylate
CAS Registry Number 41551-07-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12Fe2O14
InChI InChI=1S/C12H12O8.6CO.2Fe/c1-17-9(13)5-7(11(15)19-3)8(12(16)20-4)6-10(14)18-2;6*1-2;;/h1-4H3;;;;;;;;/q-2;;;;;;;;+2
InChIKey GLAOVNBZQIIEMC-UHFFFAOYSA-N
Molecular Weight 563.970 g/mol
SMILES COC(=O)[C-]=C(C(=O)OC)C(=[C-]C(=O)OC)C(=O)OC.[Fe].[Fe+2].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
SPLASH splash10-0012-0229400000-3984bb3ea1c649df422c
Source of Spectrum EP-6838-0-0
Synonyms Buta-1,3-diene-1,2,3,4-tetracarboxylic acid tetramethyl ester;carbon monoxide;iron;iron(2+) ferrous;carbon monoxide;iron;tetramethyl buta-1,3-diene-1,2,3,4-tetracarboxylate Carbon monoxide;iron;iron(2+);tetramethyl buta-1,3-diene-1,2,3,4-tetracarboxylate
Wiley ID 1407074