CID 708227

N-(4-methoxybenzylidene)-4-fluoroaniline

Structural Information

Molecular Formula

C₁₄H₁₂FNO

SMILES

COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)F

InChI

InChI=1S/C14H12FNO/c1-17-14-8-2-11(3-9-14)10-16-13-6-4-12(15)5-7-13/h2-10H,1H3

InChIKey

ZICFPEHQRZAFBZ-UHFFFAOYSA-N

Compound name

N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 229.09029 Da
Monoisotopic Mass: 3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	230.09757	151.0
[M+Na]+	252.07951	165.5
[M+NH4]+	247.12411	159.8
[M+K]+	268.05345	156.7
[M-H]-	228.08301	155.6
[M+Na-2H]-	250.06496	161.1
[M]+	229.08974	154.4
[M]-	229.09084	154.4

Literature stripe

literature stripe

Patent stripe

patents stripe