CID 56620163

67341-55-3

Structural Information

Molecular Formula
C3H6N4O2S2
SMILES
CNC1=NN=C(S1)S(=O)(=O)N
InChI
InChI=1S/C3H6N4O2S2/c1-5-2-6-7-3(10-2)11(4,8)9/h1H3,(H,5,6)(H2,4,8,9)
InChIKey
HVHRKSCGBXNFKB-UHFFFAOYSA-N
Compound name
5-(methylamino)-1,3,4-thiadiazole-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

193.99323 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.00051 136.1
[M+Na]+ 216.98245 146.2
[M-H]- 192.98595 137.3
[M+NH4]+ 212.02705 154.6
[M+K]+ 232.95639 142.5
[M+H-H2O]+ 176.99049 129.9
[M+HCOO]- 238.99143 150.1
[M+CH3COO]- 253.00708 180.5
[M+Na-2H]- 214.96790 139.2
[M]+ 193.99268 137.1
[M]- 193.99378 137.1
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