CID 43649246

[4-(4-fluorophenyl)-1h-imidazol-2-yl]methanamine dihydrochloride

Structural Information

Molecular Formula
C10H10FN3
SMILES
C1=CC(=CC=C1C2=CN=C(N2)CN)F
InChI
InChI=1S/C10H10FN3/c11-8-3-1-7(2-4-8)9-6-13-10(5-12)14-9/h1-4,6H,5,12H2,(H,13,14)
InChIKey
AJSVWOCYSPNHEA-UHFFFAOYSA-N
Compound name
[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

191.08588 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.093156 138.4
[M+Na]+ 214.075098 147.4
[M-H]- 190.078604 140.0
[M+NH4]+ 209.119703 156.0
[M+K]+ 230.049038 142.5
[M+H-H2O]+ 174.083140 129.7
[M+HCOO]- 236.084081 160.2
[M+CH3COO]- 250.099731 150.9
[M+Na-2H]- 212.060546 143.1
[M]+ 191.08533142 134.1
[M]- 191.08642858 134.1
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