CID 53403306

1-ethyl-1h-imidazol-4-amine hydrochloride

Structural Information

Molecular Formula
C5H9N3
SMILES
CCN1C=C(N=C1)N
InChI
InChI=1S/C5H9N3/c1-2-8-3-5(6)7-4-8/h3-4H,2,6H2,1H3
InChIKey
DPRMXZQCCDEZAL-UHFFFAOYSA-N
Compound name
1-ethylimidazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

111.07965 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.086926 120.3
[M+Na]+ 134.068868 129.5
[M-H]- 110.072374 121.3
[M+NH4]+ 129.113473 142.0
[M+K]+ 150.042808 128.3
[M+H-H2O]+ 94.076910 113.6
[M+HCOO]- 156.077851 144.8
[M+CH3COO]- 170.093501 169.9
[M+Na-2H]- 132.054316 126.9
[M]+ 111.07910142 119.1
[M]- 111.08019858 119.1
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