CID 80497727

1-(1h-imidazol-2-yl)cyclopropan-1-amine dihydrochloride

Structural Information

Molecular Formula
C6H9N3
SMILES
C1CC1(C2=NC=CN2)N
InChI
InChI=1S/C6H9N3/c7-6(1-2-6)5-8-3-4-9-5/h3-4H,1-2,7H2,(H,8,9)
InChIKey
CTVUAEFLSLBYRO-UHFFFAOYSA-N
Compound name
1-(1H-imidazol-2-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

123.07965 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.08693 125.6
[M+Na]+ 146.06887 135.8
[M-H]- 122.07237 129.2
[M+NH4]+ 141.11347 142.7
[M+K]+ 162.04281 132.6
[M+H-H2O]+ 106.07691 119.2
[M+HCOO]- 168.07785 148.4
[M+CH3COO]- 182.09350 138.9
[M+Na-2H]- 144.05432 133.1
[M]+ 123.07910 124.2
[M]- 123.08020 124.2
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.