CID 131048224

2-(2-oxo-1,3-oxazolidin-3-yl)ethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C5H8ClNO4S
SMILES
C1COC(=O)N1CCS(=O)(=O)Cl
InChI
InChI=1S/C5H8ClNO4S/c6-12(9,10)4-2-7-1-3-11-5(7)8/h1-4H2
InChIKey
FKAPNFDPERUHDV-UHFFFAOYSA-N
Compound name
2-(2-oxo-1,3-oxazolidin-3-yl)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.98625 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.993526 140.0
[M+Na]+ 235.975468 149.6
[M-H]- 211.978974 143.4
[M+NH4]+ 231.020073 159.2
[M+K]+ 251.949408 148.1
[M+H-H2O]+ 195.983510 135.9
[M+HCOO]- 257.984451 151.6
[M+CH3COO]- 272.000101 177.5
[M+Na-2H]- 233.960916 143.3
[M]+ 212.98570142 144.7
[M]- 212.98679858 144.7
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.