(6RS,1'SR,4'RS)-(1'E,3'E)-Tricarbonyliron[2,3-didehydro-1-phenyl-6-(.eta.4-1',4')-1',3'-pentadienylpiperdin-4-one]

SpectraBase Compound ID	JSU9pTKkIzR
InChI	InChI=1S/C16H17NO.3CO.Fe/c1-2-3-5-10-15-13-16(18)11-12-17(15)14-8-6-4-7-9-14;3*1-2;/h2-12,15H,13H2,1H3;;;;/t15-;;;;/m1..../s1
InChIKey	WKJLZBWHRVTQMK-FKOXPEIHSA-N Google Search
Mol Weight	379.19 g/mol
Molecular Formula	C19H17FeNO4
Exact Mass	379.050694 g/mol

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SpectraBase Spectrum ID	88KhNS9doIv
Name	(6RS,1'SR,4'RS)-(1'E,3'E)-Tricarbonyliron[2,3-didehydro-1-phenyl-6-(.eta.4-1',4')-1',3'-pentadienylpiperdin-4-one]
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H17FeNO4
InChI	InChI=1S/C16H17NO.3CO.Fe/c1-2-3-5-10-15-13-16(18)11-12-17(15)14-8-6-4-7-9-14;3*1-2;/h2-12,15H,13H2,1H3;;;;/t15-;;;;/m1..../s1
InChIKey	WKJLZBWHRVTQMK-FKOXPEIHSA-N
Molecular Weight	379.193 g/mol
SMILES	C12[Fe]3(C2[C@]2(N(C=CC(C2)=O)c2ccccc2)[H])(C1C3C)(C#[O])(C#[O])C#[O]
SPLASH	splash10-00dk-0097000000-2f15f3b14169f4b1ea0e
Source of Spectrum	E1-43-562-3
Wiley ID	1553026