CID 119031640

2-(dimethylsulfamoyl)ethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C4H10ClNO4S2
SMILES
CN(C)S(=O)(=O)CCS(=O)(=O)Cl
InChI
InChI=1S/C4H10ClNO4S2/c1-6(2)12(9,10)4-3-11(5,7)8/h3-4H2,1-2H3
InChIKey
MXZKTMVWPBZFRV-UHFFFAOYSA-N
Compound name
2-(dimethylsulfamoyl)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.97398 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.98126 152.2
[M+Na]+ 257.96320 159.5
[M+NH4]+ 253.00780 158.2
[M+K]+ 273.93714 153.2
[M-H]- 233.96670 149.3
[M+Na-2H]- 255.94865 152.9
[M]+ 234.97343 153.3
[M]- 234.97453 153.3
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.