SpectraBase Spectrum ID |
FQR8miYaPl4 |
Name |
Tricarbonyl-[4-isopropylcyclohepta-4,6-diene-1,3-dione]iron |
Alternate Name(s) |
Tricarbonyl-[5-isopropylcyclohepta-2,4-diene-1,6-dione]-iron |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H12FeO5 |
InChI |
InChI=1S/C10H12O2.3CO.Fe/c1-7(2)9-5-3-4-8(11)6-10(9)12;3*1-2;/h3-5,7H,6H2,1-2H3;;;; |
InChIKey |
VVQJCNNAFMLSLB-UHFFFAOYSA-N |
Molecular Weight |
304.079 g/mol |
SMILES |
[Fe].C1(C(=CC=CC(C1)=O)C(C)C)=O.[O+]#[C-].[O+]#[C-].[O+]#[C-] |
SPLASH |
splash10-00dj-0190000000-d4fdcf55a3f2fd1784ba |
Source of Spectrum |
AG-570-265-0 |
Wiley ID |
1306052 |