CID 21546144

2-aminoethane-1-sulfonyl fluoride hydrochloride

Structural Information

Molecular Formula

C₂H₆FNO₂S

SMILES

C(CS(=O)(=O)F)N

InChI

InChI=1S/C2H6FNO2S/c3-7(5,6)2-1-4/h1-2,4H2

InChIKey

LAQDLNOKUZORHU-UHFFFAOYSA-N

Compound name

2-aminoethanesulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 127.01033 Da
Monoisotopic Mass: -0.8
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]+	128.01761	122.2
[M+Na]+	149.99955	130.0
[M+NH4]+	145.04415	129.0
[M+K]+	165.97349	124.7
[M-H]-	126.00305	119.4
[M+Na-2H]-	147.98500	124.3
[M]+	127.00978	122.5
[M]-	127.01088	122.5

Literature stripe

literature stripe

Patent stripe

patents stripe