CID 202200

Imidazole, 4-(2-(2-naphthyloxy)ethyl)-

Structural Information

Molecular Formula

C₁₅H₁₄N₂O

SMILES

C1=CC=C2C=C(C=CC2=C1)OCCC3=CN=CN3

InChI

InChI=1S/C15H14N2O/c1-2-4-13-9-15(6-5-12(13)3-1)18-8-7-14-10-16-11-17-14/h1-6,9-11H,7-8H2,(H,16,17)

InChIKey

PGMKRSXAILDXTQ-UHFFFAOYSA-N

Compound name

5-(2-naphthalen-2-yloxyethyl)-1H-imidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 8
Patents: 238.11061 Da
Monoisotopic Mass: 3.3
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]+	239.11789	153.5
[M+Na]+	261.09983	169.1
[M+NH4]+	256.14443	162.4
[M+K]+	277.07377	162.1
[M-H]-	237.10333	157.3
[M+Na-2H]-	259.08528	163.1
[M]+	238.11006	156.9
[M]-	238.11116	156.9

Literature stripe

literature stripe

Patent stripe

patents stripe