CID 122163704

Azetidine-3-sulfonyl fluoride hydrochloride

Structural Information

Molecular Formula

C₃H₆FNO₂S

SMILES

C1C(CN1)S(=O)(=O)F

InChI

InChI=1S/C3H6FNO2S/c4-8(6,7)3-1-5-2-3/h3,5H,1-2H2

InChIKey

BEPOTUKGROTUGJ-UHFFFAOYSA-N

Compound name

azetidine-3-sulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 139.01033 Da
Monoisotopic Mass: -0.4
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]+	140.01761	124.0
[M+Na]+	161.99955	128.1
[M+NH4]+	157.04415	126.9
[M+K]+	177.97349	125.0
[M-H]-	138.00305	118.7
[M+Na-2H]-	159.98500	124.5
[M]+	139.00978	122.0
[M]-	139.01088	122.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.