CID 924717

53314-16-2

Structural Information

Molecular Formula

C₁₅H₁₄N₂O

SMILES

CC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C15H14N2O/c1-10-3-8-13-14(9-10)17-15(16-13)11-4-6-12(18-2)7-5-11/h3-9H,1-2H3,(H,16,17)

InChIKey

BSPXLUNXIPOSMM-UHFFFAOYSA-N

Compound name

2-(4-methoxyphenyl)-6-methyl-1H-benzimidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 238.11061 Da
Monoisotopic Mass: 3.6
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	153.3
[M+Na]+	261.09983	169.7
[M+NH4]+	256.14443	162.3
[M+K]+	277.07377	163.2
[M-H]-	237.10333	157.4
[M+Na-2H]-	259.08528	162.5
[M]+	238.11006	157.0
[M]-	238.11116	157.0

Literature stripe

literature stripe

Patent stripe

patents stripe