CID 18679681

1,2,4-thiadiazole-3-sulfonamide

Structural Information

Molecular Formula
C2H3N3O2S2
SMILES
C1=NC(=NS1)S(=O)(=O)N
InChI
InChI=1S/C2H3N3O2S2/c3-9(6,7)2-4-1-8-5-2/h1H,(H2,3,6,7)
InChIKey
REUQZLGMVDQWBR-UHFFFAOYSA-N
Compound name
1,2,4-thiadiazole-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

164.96667 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.97395 129.1
[M+Na]+ 187.95589 140.0
[M-H]- 163.95939 130.4
[M+NH4]+ 183.00049 148.9
[M+K]+ 203.92983 136.9
[M+H-H2O]+ 147.96393 123.4
[M+HCOO]- 209.96487 142.7
[M+CH3COO]- 223.98052 171.5
[M+Na-2H]- 185.94134 132.3
[M]+ 164.96612 130.3
[M]- 164.96722 130.3
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