CID 165868819

2-chloro-6-fluorobenzene-1-sulfonyl fluoride

Structural Information

Molecular Formula
C6H3ClF2O2S
SMILES
C1=CC(=C(C(=C1)Cl)S(=O)(=O)F)F
InChI
InChI=1S/C6H3ClF2O2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H
InChIKey
HQGQEELXMZIHGN-UHFFFAOYSA-N
Compound name
2-chloro-6-fluorobenzenesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.95103 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.95831 131.1
[M+Na]+ 234.94025 143.2
[M-H]- 210.94375 133.5
[M+NH4]+ 229.98485 151.7
[M+K]+ 250.91419 138.6
[M+H-H2O]+ 194.94829 125.7
[M+HCOO]- 256.94923 144.0
[M+CH3COO]- 270.96488 180.4
[M+Na-2H]- 232.92570 135.4
[M]+ 211.95048 133.5
[M]- 211.95158 133.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.