CID 84724

5-amino-1,3,4-thiadiazole-2-sulfonamide

Structural Information

Molecular Formula
C2H4N4O2S2
SMILES
C1(=NN=C(S1)S(=O)(=O)N)N
InChI
InChI=1S/C2H4N4O2S2/c3-1-5-6-2(9-1)10(4,7)8/h(H2,3,5)(H2,4,7,8)
InChIKey
VGMVBPQOACUDRU-UHFFFAOYSA-N
Compound name
5-amino-1,3,4-thiadiazole-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

81
References

456
Patents

179.97757 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.98485 131.9
[M+Na]+ 202.96679 142.5
[M-H]- 178.97029 132.8
[M+NH4]+ 198.01139 150.6
[M+K]+ 218.94073 138.6
[M+H-H2O]+ 162.97483 125.9
[M+HCOO]- 224.97577 145.6
[M+CH3COO]- 238.99142 177.0
[M+Na-2H]- 200.95224 134.4
[M]+ 179.97702 131.6
[M]- 179.97812 131.6
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