CID 518696

Iron(iii) oxide

Structural Information

Molecular Formula

SMILES

O=[Fe]O[Fe]=O

InChI

InChI=1S/2Fe.3O

InChIKey

JEIPFZHSYJVQDO-UHFFFAOYSA-N

Compound name

oxo(oxoferriooxy)iron

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 0
References: 133286
Patents: 159.85461 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	160.86189	119.7
[M+Na]+	182.84383	130.4
[M+NH4]+	177.88843	127.2
[M+K]+	198.81777	125.2
[M-H]-	158.84733	118.2
[M+Na-2H]-	180.82928	123.4
[M]+	159.85406	120.4
[M]-	159.85516	120.4

Literature stripe

literature stripe

Patent stripe

patents stripe