CID 1286606

Ethyl-m-tolyl-o-tolyl-amine

Structural Information

Molecular Formula

C₁₆H₁₉N

SMILES

CCN(C1=CC=CC(=C1)C)C2=CC=CC=C2C

InChI

InChI=1S/C16H19N/c1-4-17(15-10-7-8-13(2)12-15)16-11-6-5-9-14(16)3/h5-12H,4H2,1-3H3

InChIKey

ARJUMDCFZHIWTD-UHFFFAOYSA-N

Compound name

N-ethyl-2-methyl-N-(3-methylphenyl)aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 225.15175 Da
Monoisotopic Mass: 4.7
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]+	226.15903	152.3
[M+Na]+	248.14097	159.3
[M-H]-	224.14447	160.5
[M+NH4]+	243.18557	171.1
[M+K]+	264.11491	156.3
[M+H-H2O]+	208.14901	144.6
[M+HCOO]-	270.14995	177.6
[M+CH3COO]-	284.16560	198.6
[M+Na-2H]-	246.12642	157.5
[M]+	225.15120	153.4
[M]-	225.15230	153.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.