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

6
Patents

202.09062 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.097896 142.4
[M+Na]+ 225.079838 149.9
[M-H]- 201.083344 146.1
[M+NH4]+ 220.124443 159.3
[M+K]+ 241.053778 145.7
[M+H-H2O]+ 185.087880 133.6
[M+HCOO]- 247.088821 164.5
[M+CH3COO]- 261.104471 187.5
[M+Na-2H]- 223.065286 148.6
[M]+ 202.09007142 138.3
[M]- 202.09116858 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