CID 3840092

4-(dimethylsulfamoyl)benzene-1-sulfonyl chloride

Structural Information

Molecular Formula
C8H10ClNO4S2
SMILES
CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)Cl
InChI
InChI=1S/C8H10ClNO4S2/c1-10(2)16(13,14)8-5-3-7(4-6-8)15(9,11)12/h3-6H,1-2H3
InChIKey
MONMTDYGPKNEOH-UHFFFAOYSA-N
Compound name
4-(dimethylsulfamoyl)benzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

282.97397 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.98125 161.4
[M+Na]+ 305.96319 171.4
[M+NH4]+ 301.00779 168.1
[M+K]+ 321.93713 163.9
[M-H]- 281.96669 161.3
[M+Na-2H]- 303.94864 165.6
[M]+ 282.97342 163.9
[M]- 282.97452 163.9
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

patents stripe