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N-{(2RS,5SR)-(2E,4E)-Tricarbonyliron[(.eta.(4)-2,5)-2,4-hexadienylidene]}phenylamine
SpectraBase Compound ID GNc1uyF5Exi
InChI InChI=1S/C12H13N.3CO.Fe/c1-2-3-4-8-11-13-12-9-6-5-7-10-12;3*1-2;/h2-11H,1H3;;;;/b13-11+;;;;
InChIKey MGGNXKOVPLAJMK-GMSJRHDLSA-N
Mol Weight 311.12 g/mol
Molecular Formula C15H13FeNO3
Exact Mass 311.024479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZ8Tw5DCJfC
Name N-{(2RS,5SR)-(2E,4E)-Tricarbonyliron[(.eta.(4)-2,5)-2,4-hexadienylidene]}phenylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13FeNO3
InChI InChI=1S/C12H13N.3CO.Fe/c1-2-3-4-8-11-13-12-9-6-5-7-10-12;3*1-2;/h2-11H,1H3;;;;/b13-11+;;;;
InChIKey MGGNXKOVPLAJMK-GMSJRHDLSA-N
Molecular Weight 311.118 g/mol
SMILES C12[Fe]3(C2\C=N\c2ccccc2)(C1C3C)(C#[O])(C#[O])C#[O]
SPLASH splash10-05fr-0960000000-1aa6d24aa9d4fc896bcf
Source of Spectrum E1-43-561-2
Wiley ID 1553031