CID 853472

1-(2-naphthoyl)imidazole

Structural Information

Molecular Formula

C₁₄H₁₀N₂O

SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)N3C=CN=C3

InChI

InChI=1S/C14H10N2O/c17-14(16-8-7-15-10-16)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H

InChIKey

FEYNPDBWOXBMOB-UHFFFAOYSA-N

Compound name

imidazol-1-yl(naphthalen-2-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 222.07932 Da
Monoisotopic Mass: 2.8
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]+	223.08660	147.5
[M+Na]+	245.06854	163.5
[M+NH4]+	240.11314	156.6
[M+K]+	261.04248	157.3
[M-H]-	221.07204	151.4
[M+Na-2H]-	243.05399	157.6
[M]+	222.07877	151.0
[M]-	222.07987	151.0

Literature stripe

literature stripe

Patent stripe

patents stripe