CID 2740061

4-bromo-5-chlorothiophene-2-sulfonamide

Structural Information

Molecular Formula
C4H3BrClNO2S2
SMILES
C1=C(SC(=C1Br)Cl)S(=O)(=O)N
InChI
InChI=1S/C4H3BrClNO2S2/c5-2-1-3(10-4(2)6)11(7,8)9/h1H,(H2,7,8,9)
InChIKey
PHEHCZUMVYYMMY-UHFFFAOYSA-N
Compound name
4-bromo-5-chlorothiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

24
Patents

274.84772 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.854996 133.6
[M+Na]+ 297.836938 149.4
[M-H]- 273.840444 140.9
[M+NH4]+ 292.881543 156.8
[M+K]+ 313.810878 134.9
[M+H-H2O]+ 257.844980 135.8
[M+HCOO]- 319.845921 142.9
[M+CH3COO]- 333.861571 188.2
[M+Na-2H]- 295.822386 137.7
[M]+ 274.84717142 155.1
[M]- 274.84826858 155.1
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