CID 138394854

Dtxsid1051640

Structural Information

Molecular Formula

SMILES

O=[Cr]O[Fe]=O

InChI

InChI=1S/Cr.Fe.3O

InChIKey

BPTIQQPCZIPFFJ-UHFFFAOYSA-N

Compound name

oxo(oxochromiooxy)iron

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 155.86018 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]+	156.86746	119.9
[M+Na]+	178.84940	128.8
[M-H]-	154.85290	120.3
[M+NH4]+	173.89400	143.4
[M+K]+	194.82334	129.5
[M+H-H2O]+	138.85744	115.3
[M+HCOO]-	200.85838	145.3
[M+CH3COO]-	214.87403	161.6
[M+Na-2H]-	176.83485	127.9
[M]+	155.85963	122.7
[M]-	155.86073	122.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.