SpectraBase Spectrum ID |
BqaH1j9mUI3 |
Name |
(6RS,1'SR,4'RS)-(1'E,3'E)-Tricarbonyliron[2,3-didehydro-1-benzyl-6-(.eta.4-1',4')-1',3'-pentadienylpiperdin-4-one] |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H19FeNO4 |
InChI |
InChI=1S/C17H19NO.3CO.Fe/c1-2-3-5-10-16-13-17(19)11-12-18(16)14-15-8-6-4-7-9-15;3*1-2;/h2-12,16H,13-14H2,1H3;;;;/t16-;;;;/m1..../s1 |
InChIKey |
GIZWAOVASQYTLU-XIYRCBLHSA-N |
Molecular Weight |
393.220 g/mol |
SMILES |
C12[Fe]3(C2[C@]2(N(C=CC(C2)=O)Cc2ccccc2)[H])(C1C3C)(C#[O])(C#[O])C#[O] |
SPLASH |
splash10-0a4i-0009000000-a3fe0c979b62fd675e8e |
Source of Spectrum |
E1-43-562-3 |
Wiley ID |
1553027 |