For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Tricarbonyl[(1-4-.eta.)-5-(2-amino-3-methoxy-5-formylphenyl)-1,3-cyclohexadiene]iron
SpectraBase Compound ID Dgw1d0f6lx4
InChI InChI=1S/C14H15NO2.3CO.Fe/c1-17-13-8-10(9-16)7-12(14(13)15)11-5-3-2-4-6-11;3*1-2;/h2-5,7-9,11H,6,15H2,1H3;;;;
InChIKey WOKQGHZBBPQOLH-UHFFFAOYSA-N
Mol Weight 369.15 g/mol
Molecular Formula C17H15FeNO5
Exact Mass 369.029959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3rWngcrHbC2
Name Tricarbonyl[(1-4-.eta.)-5-(2-amino-3-methoxy-5-formylphenyl)-1,3-cyclohexadiene]iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15FeNO5
InChI InChI=1S/C14H15NO2.3CO.Fe/c1-17-13-8-10(9-16)7-12(14(13)15)11-5-3-2-4-6-11;3*1-2;/h2-5,7-9,11H,6,15H2,1H3;;;;
InChIKey WOKQGHZBBPQOLH-UHFFFAOYSA-N
Molecular Weight 369.154 g/mol
SMILES Nc1c(C2[C@@]3([Fe]45([C@@]3([C@]5([C@]4(C2)[H])[H])[H])(C#[O])(C#[O])C#[O])[H])cc(cc1OC)C=O
SPLASH splash10-0a5i-0092000000-58bd61bf7fb0aca4b8f8
Source of Spectrum F-49-11231-6
Synonyms 4-Amino-3-methoxy-5-[1,1,1-tris(hydroxymethyl)-1-ferratetracyclo[3.2.0.0(1,6).0(2,7)]heptan-3-yl]benzaldehyde
Wiley ID 789048