CID 131326528

5-aminopyridine-2-sulfonyl fluoride

Structural Information

Molecular Formula

C₅H₅FN₂O₂S

SMILES

C1=CC(=NC=C1N)S(=O)(=O)F

InChI

InChI=1S/C5H5FN2O2S/c6-11(9,10)5-2-1-4(7)3-8-5/h1-3H,7H2

InChIKey

OYGMUZIYWQQOHB-UHFFFAOYSA-N

Compound name

5-aminopyridine-2-sulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 176.00557 Da
Monoisotopic Mass: 0.3
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]+	177.01285	131.9
[M+Na]+	198.99479	142.2
[M+NH4]+	194.03939	138.7
[M+K]+	214.96873	136.3
[M-H]-	174.99829	131.1
[M+Na-2H]-	196.98024	137.1
[M]+	176.00502	133.3
[M]-	176.00612	133.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe