CID 1241301

5-chlorothiophene-2-sulfonamide

Structural Information

Molecular Formula
C4H4ClNO2S2
SMILES
C1=C(SC(=C1)Cl)S(=O)(=O)N
InChI
InChI=1S/C4H4ClNO2S2/c5-3-1-2-4(9-3)10(6,7)8/h1-2H,(H2,6,7,8)
InChIKey
RKLQLYBJAZBSEU-UHFFFAOYSA-N
Compound name
5-chlorothiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

526
Patents

196.9372 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.94448 136.8
[M+Na]+ 219.92642 147.8
[M-H]- 195.92992 141.0
[M+NH4]+ 214.97102 159.0
[M+K]+ 235.90036 142.7
[M+H-H2O]+ 179.93446 133.3
[M+HCOO]- 241.93540 147.5
[M+CH3COO]- 255.95105 177.0
[M+Na-2H]- 217.91187 138.4
[M]+ 196.93665 139.8
[M]- 196.93775 139.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe