CID 2758563

415913-06-3

Structural Information

Molecular Formula
C5H9N3O2S
SMILES
CC1=NC(=CN1C)S(=O)(=O)N
InChI
InChI=1S/C5H9N3O2S/c1-4-7-5(3-8(4)2)11(6,9)10/h3H,1-2H3,(H2,6,9,10)
InChIKey
IBPSPEHRHLEXKB-UHFFFAOYSA-N
Compound name
1,2-dimethylimidazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

175.04155 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.04883 134.3
[M+Na]+ 198.03077 145.4
[M-H]- 174.03427 136.2
[M+NH4]+ 193.07537 154.3
[M+K]+ 214.00471 143.2
[M+H-H2O]+ 158.03881 128.5
[M+HCOO]- 220.03975 152.6
[M+CH3COO]- 234.05540 177.7
[M+Na-2H]- 196.01622 137.3
[M]+ 175.04100 136.6
[M]- 175.04210 136.6
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