CID 819489

53566-95-3

Structural Information

Molecular Formula

C₂₀H₁₅NO₂

SMILES

C1=CC=C(C=C1)N(C2=CC=C(C=C2)C=O)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C20H15NO2/c22-14-16-6-10-19(11-7-16)21(18-4-2-1-3-5-18)20-12-8-17(15-23)9-13-20/h1-15H

InChIKey

DOUAFMIJGIUWJX-UHFFFAOYSA-N

Compound name

4-(N-(4-formylphenyl)anilino)benzaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 240
Patents: 301.1103 Da
Monoisotopic Mass: 4.1
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]+	302.11758	171.2
[M+Na]+	324.09952	187.7
[M+NH4]+	319.14412	180.1
[M+K]+	340.07346	178.2
[M-H]-	300.10302	179.2
[M+Na-2H]-	322.08497	183.9
[M]+	301.10975	176.0
[M]-	301.11085	176.0

Literature stripe

literature stripe

Patent stripe

patents stripe