CID 9855613

4-fluoropyridine-3-sulfonamide

Structural Information

Molecular Formula
C5H5FN2O2S
SMILES
C1=CN=CC(=C1F)S(=O)(=O)N
InChI
InChI=1S/C5H5FN2O2S/c6-4-1-2-8-3-5(4)11(7,9)10/h1-3H,(H2,7,9,10)
InChIKey
QZPPFDFOCKTYHK-UHFFFAOYSA-N
Compound name
4-fluoropyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.00557 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.01285 129.7
[M+Na]+ 198.99479 139.9
[M-H]- 174.99829 131.1
[M+NH4]+ 194.03939 148.6
[M+K]+ 214.96873 136.8
[M+H-H2O]+ 159.00283 123.0
[M+HCOO]- 221.00377 147.5
[M+CH3COO]- 235.01942 176.4
[M+Na-2H]- 196.98024 135.3
[M]+ 176.00502 129.2
[M]- 176.00612 129.2
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.