CID 165970569

2-chloro-5-fluoropyridine-3-sulfonyl fluoride

Structural Information

Molecular Formula
C5H2ClF2NO2S
SMILES
C1=C(C=NC(=C1S(=O)(=O)F)Cl)F
InChI
InChI=1S/C5H2ClF2NO2S/c6-5-4(12(8,10)11)1-3(7)2-9-5/h1-2H
InChIKey
MIDODXNNRCZFBF-UHFFFAOYSA-N
Compound name
2-chloro-5-fluoropyridine-3-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.94629 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.95357 130.9
[M+Na]+ 235.93551 143.4
[M-H]- 211.93901 132.0
[M+NH4]+ 230.98011 150.1
[M+K]+ 251.90945 139.0
[M+H-H2O]+ 195.94355 124.7
[M+HCOO]- 257.94449 142.8
[M+CH3COO]- 271.96014 180.0
[M+Na-2H]- 233.92096 135.7
[M]+ 212.94574 133.3
[M]- 212.94684 133.3
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.