CID 147035

102390-63-6

Structural Information

Molecular Formula

C₁₇H₁₆N₂

SMILES

C1=CC=C(C=C1)C(CC2=CN=CN2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2/c1-3-7-14(8-4-1)17(11-16-12-18-13-19-16)15-9-5-2-6-10-15/h1-10,12-13,17H,11H2,(H,18,19)

InChIKey

CGWCKWISXYESMC-UHFFFAOYSA-N

Compound name

5-(2,2-diphenylethyl)-1H-imidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 18
Patents: 248.13135 Da
Monoisotopic Mass: 3.8
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]+	249.13863	159.4
[M+Na]+	271.12057	174.4
[M+NH4]+	266.16517	168.3
[M+K]+	287.09451	167.4
[M-H]-	247.12407	164.9
[M+Na-2H]-	269.10602	170.7
[M]+	248.13080	163.2
[M]-	248.13190	163.2

Literature stripe

literature stripe

Patent stripe

patents stripe