CID 116649

2,2'-diethyldiphenylamine

Structural Information

Molecular Formula

C₁₆H₁₉N

SMILES

CCC1=CC=CC=C1NC2=CC=CC=C2CC

InChI

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

InChIKey

RZFNPHWOOGJMQE-UHFFFAOYSA-N

Compound name

2-ethyl-N-(2-ethylphenyl)aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 62
Patents: 225.15175 Da
Monoisotopic Mass: 5.1
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]+	226.15903	153.9
[M+Na]+	248.14097	169.0
[M+NH4]+	243.18557	163.8
[M+K]+	264.11491	159.5
[M-H]-	224.14447	160.4
[M+Na-2H]-	246.12642	164.4
[M]+	225.15120	158.1
[M]-	225.15230	158.1

Literature stripe

literature stripe

Patent stripe

patents stripe