CID 19865103

4-fluorobenzene-1-sulfonylbromide

Structural Information

Molecular Formula

C₆H₄BrFO₂S

SMILES

C1=CC(=CC=C1F)S(=O)(=O)Br

InChI

InChI=1S/C6H4BrFO2S/c7-11(9,10)6-3-1-5(8)2-4-6/h1-4H

InChIKey

ULKSBNNXKJWYFZ-UHFFFAOYSA-N

Compound name

4-fluorobenzenesulfonyl bromide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 237.90994 Da
Monoisotopic Mass: 2.2
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]+	238.91722	130.0
[M+Na]+	260.89916	132.9
[M+NH4]+	255.94376	134.6
[M+K]+	276.87310	132.4
[M-H]-	236.90266	128.8
[M+Na-2H]-	258.88461	133.6
[M]+	237.90939	129.2
[M]-	237.91049	129.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe