CID 54594245

7-fluoro-1,2,3,4-tetrahydroquinolin-4-amine

Structural Information

Molecular Formula
C9H11FN2
SMILES
C1CNC2=C(C1N)C=CC(=C2)F
InChI
InChI=1S/C9H11FN2/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-2,5,8,12H,3-4,11H2
InChIKey
BDIIIYWBLXIJNO-UHFFFAOYSA-N
Compound name
7-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.09062 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.09790 132.8
[M+Na]+ 189.07984 140.4
[M-H]- 165.08334 132.7
[M+NH4]+ 184.12444 152.1
[M+K]+ 205.05378 136.1
[M+H-H2O]+ 149.08788 125.7
[M+HCOO]- 211.08882 151.0
[M+CH3COO]- 225.10447 144.8
[M+Na-2H]- 187.06529 139.2
[M]+ 166.09007 125.3
[M]- 166.09117 125.3
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

No patent data available for this compound.