CID 2734613

N-(4-fluorobenzylidene)-4-fluoroaniline

Structural Information

Molecular Formula
C13H9F2N
SMILES
C1=CC(=CC=C1C=NC2=CC=C(C=C2)F)F
InChI
InChI=1S/C13H9F2N/c14-11-3-1-10(2-4-11)9-16-13-7-5-12(15)6-8-13/h1-9H
InChIKey
FRNJXANITCYEMD-UHFFFAOYSA-N
Compound name
N,1-bis(4-fluorophenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

217.07031 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.07759 143.1
[M+Na]+ 240.05953 152.2
[M-H]- 216.06303 149.0
[M+NH4]+ 235.10413 162.1
[M+K]+ 256.03347 147.8
[M+H-H2O]+ 200.06757 134.0
[M+HCOO]- 262.06851 168.5
[M+CH3COO]- 276.08416 192.7
[M+Na-2H]- 238.04498 150.0
[M]+ 217.06976 140.9
[M]- 217.07086 140.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe