CID 12443805

5-methyl-4,5-dihydro-1h-imidazol-2-amine hydrobromide

Structural Information

Molecular Formula
C4H9N3
SMILES
CC1CN=C(N1)N
InChI
InChI=1S/C4H9N3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3,(H3,5,6,7)
InChIKey
REEBTHVEGMVLIR-UHFFFAOYSA-N
Compound name
5-methyl-4,5-dihydro-1H-imidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

83
Patents

99.07965 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.086926 118.7
[M+Na]+ 122.068868 126.8
[M-H]- 98.072374 118.1
[M+NH4]+ 117.113473 140.0
[M+K]+ 138.042808 125.2
[M+H-H2O]+ 82.076910 112.3
[M+HCOO]- 144.077851 140.5
[M+CH3COO]- 158.093501 164.6
[M+Na-2H]- 120.054316 124.2
[M]+ 99.07910142 113.8
[M]- 99.08019858 113.8
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