CID 66997355

3'-ethoxy-3-fluorobiphenyl-4-amine

Structural Information

Molecular Formula

C₁₄H₁₄FNO

SMILES

CCOC1=CC=CC(=C1)C2=CC(=C(C=C2)N)F

InChI

InChI=1S/C14H14FNO/c1-2-17-12-5-3-4-10(8-12)11-6-7-14(16)13(15)9-11/h3-9H,2,16H2,1H3

InChIKey

ULFLHZVDFOHESL-UHFFFAOYSA-N

Compound name

4-(3-ethoxyphenyl)-2-fluoroaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 231.10594 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]+	232.11322	151.9
[M+Na]+	254.09516	165.9
[M+NH4]+	249.13976	160.5
[M+K]+	270.06910	157.9
[M-H]-	230.09866	156.2
[M+Na-2H]-	252.08061	160.9
[M]+	231.10539	155.2
[M]-	231.10649	155.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe