CID 43363637

776-09-0

Structural Information

Molecular Formula

C₆HClF₄O₂S

SMILES

C1=C(C(=C(C(=C1F)F)S(=O)(=O)Cl)F)F

InChI

InChI=1S/C6HClF4O2S/c7-14(12,13)6-4(10)2(8)1-3(9)5(6)11/h1H

InChIKey

WQJDRBBQQXGDNZ-UHFFFAOYSA-N

Compound name

2,3,5,6-tetrafluorobenzenesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 247.93219 Da
Monoisotopic Mass: 2.5
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]+	248.93947	151.0
[M+Na]+	270.92141	160.0
[M+NH4]+	265.96601	155.8
[M+K]+	286.89535	153.7
[M-H]-	246.92491	146.5
[M+Na-2H]-	268.90686	153.3
[M]+	247.93164	151.3
[M]-	247.93274	151.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe