CID 5460605

Dioxygen(.1+)

Structural Information

Molecular Formula

O₂

SMILES

O=[O+]

InChI

InChI=1S/O2/c1-2/q+1

InChIKey

KMHJKRGRIJONSV-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 31.98983 Da
Monoisotopic Mass: -1.1
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]+	32.997106	94.4
[M+Na]+	54.979048	104.5
[M-H]-	30.982554	96.2
[M+NH4]+	50.023653	120.2
[M+K]+	70.952988	101.1
[M+H-H2O]+	14.987090	94.3
[M+HCOO]-	76.988031	120.7
[M+CH3COO]-	91.003681	146.0
[M+Na-2H]-	52.964496	107.3
[M]+	31.989281	94.5
[M]-	31.990379	94.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.