CID 86767708

4-amino-n-(2-hydroxyethyl)-1,2-dimethyl-1h-imidazole-5-carboxamide

Structural Information

Molecular Formula
C8H14N4O2
SMILES
CC1=NC(=C(N1C)C(=O)NCCO)N
InChI
InChI=1S/C8H14N4O2/c1-5-11-7(9)6(12(5)2)8(14)10-3-4-13/h13H,3-4,9H2,1-2H3,(H,10,14)
InChIKey
HOQHJGVESUYQFU-UHFFFAOYSA-N
Compound name
5-amino-N-(2-hydroxyethyl)-2,3-dimethylimidazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.11168 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.11896 143.8
[M+Na]+ 221.10090 152.1
[M-H]- 197.10440 143.9
[M+NH4]+ 216.14550 161.3
[M+K]+ 237.07484 150.1
[M+H-H2O]+ 181.10894 136.7
[M+HCOO]- 243.10988 166.4
[M+CH3COO]- 257.12553 187.5
[M+Na-2H]- 219.08635 146.1
[M]+ 198.11113 143.2
[M]- 198.11223 143.2
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.