CID 5198216

N,n'-bis(3,4-dimethoxybenzylidene)-1,4-phenylenediamine

Structural Information

Molecular Formula

C₂₄H₂₄N₂O₄

SMILES

COC1=C(C=C(C=C1)C=NC2=CC=C(C=C2)N=CC3=CC(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C24H24N2O4/c1-27-21-11-5-17(13-23(21)29-3)15-25-19-7-9-20(10-8-19)26-16-18-6-12-22(28-2)24(14-18)30-4/h5-16H,1-4H3

InChIKey

AOJIIZRJWDDLJX-UHFFFAOYSA-N

Compound name

1-(3,4-dimethoxyphenyl)-N-[4-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]methanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 404.1736 Da
Monoisotopic Mass: 4.4
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]+	405.180876	198.9
[M+Na]+	427.162818	206.1
[M-H]-	403.166324	211.4
[M+NH4]+	422.207423	210.4
[M+K]+	443.136758	202.8
[M+H-H2O]+	387.170860	187.2
[M+HCOO]-	449.171801	227.1
[M+CH3COO]-	463.187451	234.0
[M+Na-2H]-	425.148266	202.1
[M]+	404.17305142	206.8
[M]-	404.17414858	206.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.