CID 462451

1-(4-fluorophenyl)-n-(3-quinolyl)methanimine

Structural Information

Molecular Formula
C16H11FN2
SMILES
C1=CC=C2C(=C1)C=C(C=N2)N=CC3=CC=C(C=C3)F
InChI
InChI=1S/C16H11FN2/c17-14-7-5-12(6-8-14)10-18-15-9-13-3-1-2-4-16(13)19-11-15/h1-11H
InChIKey
KUXIARCVPKLXPD-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-N-quinolin-3-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.09062 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.09790 154.2
[M+Na]+ 273.07984 163.4
[M-H]- 249.08334 160.5
[M+NH4]+ 268.12444 171.3
[M+K]+ 289.05378 157.6
[M+H-H2O]+ 233.08788 144.1
[M+HCOO]- 295.08882 178.0
[M+CH3COO]- 309.10447 166.8
[M+Na-2H]- 271.06529 163.3
[M]+ 250.09007 153.2
[M]- 250.09117 153.2
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.