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]+ 167.097896 132.8
[M+Na]+ 189.079838 140.4
[M-H]- 165.083344 132.7
[M+NH4]+ 184.124443 152.1
[M+K]+ 205.053778 136.1
[M+H-H2O]+ 149.087880 125.7
[M+HCOO]- 211.088821 151.0
[M+CH3COO]- 225.104471 144.8
[M+Na-2H]- 187.065286 139.2
[M]+ 166.09007142 125.3
[M]- 166.09116858 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.