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]+ 213.99353 140.0
[M+Na]+ 235.97547 149.6
[M-H]- 211.97897 143.4
[M+NH4]+ 231.02007 159.2
[M+K]+ 251.94941 148.1
[M+H-H2O]+ 195.98351 135.9
[M+HCOO]- 257.98445 151.6
[M+CH3COO]- 272.00010 177.5
[M+Na-2H]- 233.96092 143.3
[M]+ 212.98570 144.7
[M]- 212.98680 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.