CID 279492

4-amino-1-methyl-1h-imidazole-5-sulfonamide

Structural Information

Molecular Formula
C4H8N4O2S
SMILES
CN1C=NC(=C1S(=O)(=O)N)N
InChI
InChI=1S/C4H8N4O2S/c1-8-2-7-3(5)4(8)11(6,9)10/h2H,5H2,1H3,(H2,6,9,10)
InChIKey
BHPVQPUZTGMFMN-UHFFFAOYSA-N
Compound name
5-amino-3-methylimidazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.0368 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.04408 133.7
[M+Na]+ 199.02602 144.2
[M-H]- 175.02952 135.1
[M+NH4]+ 194.07062 152.8
[M+K]+ 214.99996 141.7
[M+H-H2O]+ 159.03406 127.5
[M+HCOO]- 221.03500 152.6
[M+CH3COO]- 235.05065 179.2
[M+Na-2H]- 197.01147 136.8
[M]+ 176.03625 133.7
[M]- 176.03735 133.7
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

No patent data available for this compound.