CID 120225

1-chlorosulfonyloxy-2-fluoroethane

Structural Information

Molecular Formula

C₂H₄ClFO₃S

SMILES

C(CF)OS(=O)(=O)Cl

InChI

InChI=1S/C2H4ClFO3S/c3-8(5,6)7-2-1-4/h1-2H2

InChIKey

XEMULNWDKOXYNZ-UHFFFAOYSA-N

Compound name

1-chlorosulfonyloxy-2-fluoroethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 161.95537 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]+	162.96265	121.8
[M+Na]+	184.94459	132.0
[M-H]-	160.94809	121.8
[M+NH4]+	179.98919	144.0
[M+K]+	200.91853	129.9
[M+H-H2O]+	144.95263	118.1
[M+HCOO]-	206.95357	135.5
[M+CH3COO]-	220.96922	170.1
[M+Na-2H]-	182.93004	127.2
[M]+	161.95482	126.6
[M]-	161.95592	126.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.