| SpectraBase Spectrum ID |
CykMETidRq9 |
| Name |
3,3,3-Tricarbonyl-4-isopropyl-1,2-diphenyl-3-(trifluoracetoxy)-1-aza-3-ferra-2-cyclobuten-4-carboxylic acid ethylester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22F3FeNO7 |
| InChI |
InChI=1S/C20H22NO2.C2HF3O2.3CO.Fe/c1-4-23-20(22)19(16(2)3)21(18-13-9-6-10-14-18)15-17-11-7-5-8-12-17;3-2(4,5)1(6)7;3*1-2;/h5-14,16H,4H2,1-3H3;(H,6,7);;;;/q-1;;;;;+2/p-1 |
| InChIKey |
JZRPMXIBNDWZGJ-UHFFFAOYSA-M |
| Literature Reference DOI |
10.1002/cber.19911240816 |
| Molecular Weight |
562.299 g/mol |
| SMILES |
C([O-])(=O)C(F)(F)F.C([C-](C(=O)OCC)N(c1ccccc1)[CH]c1ccccc1)(C)C.[Fe+2].[C-]#[O+].[C-]#[O+].[C-]#[O+] |
| SPLASH |
splash10-00kb-9520100000-def50979e951f66fab22 |
| Source of Spectrum |
K-124-1802-7a |
| Wiley ID |
1792232 |
