CID 5460629

Obro

Structural Information

Molecular Formula

SMILES

O=Br[O]

InChI

InChI=1S/BrO2/c2-1-3

InChIKey

SISAYUDTHCIGLM-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 110.90817 Da
Monoisotopic Mass: 0.4
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]+	111.91545	111.4
[M+Na]+	133.89739	124.4
[M-H]-	109.90089	114.3
[M+NH4]+	128.94199	136.8
[M+K]+	149.87133	112.0
[M+H-H2O]+	93.905430	118.2
[M+HCOO]-	155.90637	134.4
[M+CH3COO]-	169.92202	155.9
[M+Na-2H]-	131.88284	123.6
[M]+	110.90762	129.1
[M]-	110.90872	129.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.