CID 91502

Goethite (fe(oh)o)

Structural Information

Molecular Formula
FeHO2
SMILES
O[Fe]=O
InChI
InChI=1S/Fe.H2O.O/h;1H2;/q+1;;/p-1
InChIKey
AEIXRCIKZIZYPM-UHFFFAOYSA-M
Compound name
hydroxy(oxo)iron
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

854
References

1730
Patents

88.93259 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 89.939866 108.2
[M+Na]+ 111.92181 117.1
[M-H]- 87.925314 107.7
[M+NH4]+ 106.96641 132.7
[M+K]+ 127.89575 117.5
[M+H-H2O]+ 71.929850 104.6
[M+HCOO]- 133.93079 132.4
[M+CH3COO]- 147.94644 153.6
[M+Na-2H]- 109.90726 116.9
[M]+ 88.932041 107.9
[M]- 88.933139 107.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.