CID 130707531

3,5-dichloropyridine-2-sulfonyl fluoride

Structural Information

Molecular Formula
C5H2Cl2FNO2S
SMILES
C1=C(C=NC(=C1Cl)S(=O)(=O)F)Cl
InChI
InChI=1S/C5H2Cl2FNO2S/c6-3-1-4(7)5(9-2-3)12(8,10)11/h1-2H
InChIKey
OJBWJLXXWMCQGA-UHFFFAOYSA-N
Compound name
3,5-dichloropyridine-2-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.91673 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.92401 134.2
[M+Na]+ 251.90595 146.7
[M-H]- 227.90945 136.1
[M+NH4]+ 246.95055 153.1
[M+K]+ 267.87989 141.5
[M+H-H2O]+ 211.91399 129.7
[M+HCOO]- 273.91493 142.0
[M+CH3COO]- 287.93058 182.1
[M+Na-2H]- 249.89140 138.7
[M]+ 228.91618 138.4
[M]- 228.91728 138.4
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.