CID 4161478

N-(3-methoxybenzylidene)-o-toluidine

Structural Information

Molecular Formula

C₁₅H₁₅NO

SMILES

CC1=CC=CC=C1N=CC2=CC(=CC=C2)OC

InChI

InChI=1S/C15H15NO/c1-12-6-3-4-9-15(12)16-11-13-7-5-8-14(10-13)17-2/h3-11H,1-2H3

InChIKey

LGENQVXSBSICPE-UHFFFAOYSA-N

Compound name

1-(3-methoxyphenyl)-N-(2-methylphenyl)methanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 225.11537 Da
Monoisotopic Mass: 3.6
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]+	226.122646	150.0
[M+Na]+	248.104588	158.0
[M-H]-	224.108094	158.3
[M+NH4]+	243.149193	168.7
[M+K]+	264.078528	154.7
[M+H-H2O]+	208.112630	142.2
[M+HCOO]-	270.113571	177.0
[M+CH3COO]-	284.129221	195.3
[M+Na-2H]-	246.090036	156.9
[M]+	225.11482142	152.0
[M]-	225.11591858	152.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.