CID 45080588

4-aminothiophene-2-sulfonamide

Structural Information

Molecular Formula
C4H6N2O2S2
SMILES
C1=C(SC=C1N)S(=O)(=O)N
InChI
InChI=1S/C4H6N2O2S2/c5-3-1-4(9-2-3)10(6,7)8/h1-2H,5H2,(H2,6,7,8)
InChIKey
JDYQZLNQRKFDKE-UHFFFAOYSA-N
Compound name
4-aminothiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

177.98708 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.99436 133.2
[M+Na]+ 200.97630 142.7
[M-H]- 176.97980 136.3
[M+NH4]+ 196.02090 154.5
[M+K]+ 216.95024 138.5
[M+H-H2O]+ 160.98434 127.9
[M+HCOO]- 222.98528 148.5
[M+CH3COO]- 237.00093 177.5
[M+Na-2H]- 198.96175 135.0
[M]+ 177.98653 132.7
[M]- 177.98763 132.7
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