CID 60819324

(3-fluorophenyl)(pyridin-2-yl)methanamine

Structural Information

Molecular Formula
C12H11FN2
SMILES
C1=CC=NC(=C1)C(C2=CC(=CC=C2)F)N
InChI
InChI=1S/C12H11FN2/c13-10-5-3-4-9(8-10)12(14)11-6-1-2-7-15-11/h1-8,12H,14H2
InChIKey
KQZYFGZSUCYGSD-UHFFFAOYSA-N
Compound name
(3-fluorophenyl)-pyridin-2-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

202.09062 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.09790 142.4
[M+Na]+ 225.07984 149.9
[M-H]- 201.08334 146.1
[M+NH4]+ 220.12444 159.3
[M+K]+ 241.05378 145.7
[M+H-H2O]+ 185.08788 133.6
[M+HCOO]- 247.08882 164.5
[M+CH3COO]- 261.10447 187.5
[M+Na-2H]- 223.06529 148.6
[M]+ 202.09007 138.3
[M]- 202.09117 138.3
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