| SpectraBase Spectrum ID |
3rWngcrHbC2 |
| Name |
Tricarbonyl[(1-4-.eta.)-5-(2-amino-3-methoxy-5-formylphenyl)-1,3-cyclohexadiene]iron |
| Alternate Name(s) |
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 |
| 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 |
| Wiley ID |
789048 |
![Tricarbonyl[(1-4-.eta.)-5-(2-amino-3-methoxy-5-formylphenyl)-1,3-cyclohexadiene]iron](/api/spectrum/3rWngcrHbC2/structure.png?h=300&w=458 "Tricarbonyl[(1-4-.eta.)-5-(2-amino-3-methoxy-5-formylphenyl)-1,3-cyclohexadiene]iron")
