CID 28965434

[3-fluoro-4-(2-methyl-1h-imidazol-1-yl)phenyl]methanamine

Structural Information

Molecular Formula
C11H12FN3
SMILES
CC1=NC=CN1C2=C(C=C(C=C2)CN)F
InChI
InChI=1S/C11H12FN3/c1-8-14-4-5-15(8)11-3-2-9(7-13)6-10(11)12/h2-6H,7,13H2,1H3
InChIKey
VMEUQOMHWNIZJN-UHFFFAOYSA-N
Compound name
[3-fluoro-4-(2-methylimidazol-1-yl)phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.10153 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.10881 144.5
[M+Na]+ 228.09075 157.0
[M+NH4]+ 223.13535 152.1
[M+K]+ 244.06469 152.1
[M-H]- 204.09425 146.6
[M+Na-2H]- 226.07620 151.8
[M]+ 205.10098 146.7
[M]- 205.10208 146.7
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.