CID 2317489

N-(2-aminophenyl)-n-(2-phenylethyl)amine hydrochloride

Structural Information

Molecular Formula

C₁₄H₁₆N₂

SMILES

C1=CC=C(C=C1)CCNC2=CC=CC=C2N

InChI

InChI=1S/C14H16N2/c15-13-8-4-5-9-14(13)16-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11,15H2

InChIKey

UMCDLQOIKZOKNA-UHFFFAOYSA-N

Compound name

2-N-(2-phenylethyl)benzene-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 49
Patents: 212.13135 Da
Monoisotopic Mass: 3.2
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]+	213.13863	149.4
[M+Na]+	235.12057	162.9
[M+NH4]+	230.16517	158.9
[M+K]+	251.09451	154.3
[M-H]-	211.12407	155.9
[M+Na-2H]-	233.10602	159.8
[M]+	212.13080	153.2
[M]-	212.13190	153.2

Literature stripe

literature stripe

Patent stripe

patents stripe