CID 715810

38385-95-4

Structural Information

Molecular Formula

C₁₂H₁₅N₃

SMILES

C1CNCCC1C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C12H15N3/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-4,9,13H,5-8H2,(H,14,15)

InChIKey

HBOGHPAOOWUTLB-UHFFFAOYSA-N

Compound name

2-piperidin-4-yl-1H-benzimidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 241
Patents: 201.1266 Da
Monoisotopic Mass: 1.9
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]+	202.13388	145.4
[M+Na]+	224.11582	158.5
[M+NH4]+	219.16042	154.1
[M+K]+	240.08976	153.0
[M-H]-	200.11932	147.9
[M+Na-2H]-	222.10127	152.5
[M]+	201.12605	147.8
[M]-	201.12715	147.8

Literature stripe

literature stripe

Patent stripe

patents stripe