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

13
Patents

191.08588 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.09316 138.4
[M+Na]+ 214.07510 147.4
[M-H]- 190.07860 140.0
[M+NH4]+ 209.11970 156.0
[M+K]+ 230.04904 142.5
[M+H-H2O]+ 174.08314 129.7
[M+HCOO]- 236.08408 160.2
[M+CH3COO]- 250.09973 150.9
[M+Na-2H]- 212.06055 143.1
[M]+ 191.08533 134.1
[M]- 191.08643 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