CID 23358019

3-chlorothiophene-2-sulfonamide

Structural Information

Molecular Formula
C4H4ClNO2S2
SMILES
C1=CSC(=C1Cl)S(=O)(=O)N
InChI
InChI=1S/C4H4ClNO2S2/c5-3-1-2-9-4(3)10(6,7)8/h1-2H,(H2,6,7,8)
InChIKey
MGTZGHNFFLOPFR-UHFFFAOYSA-N
Compound name
3-chlorothiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

196.9372 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.944476 136.8
[M+Na]+ 219.926418 147.8
[M-H]- 195.929924 141.0
[M+NH4]+ 214.971023 159.0
[M+K]+ 235.900358 142.7
[M+H-H2O]+ 179.934460 133.3
[M+HCOO]- 241.935401 147.5
[M+CH3COO]- 255.951051 177.0
[M+Na-2H]- 217.911866 138.4
[M]+ 196.93665142 139.8
[M]- 196.93774858 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

No literature data available for this compound.

Patent stripe

patents stripe