CID 1084419

2-cyclopropyl-1h-benzimidazole

Structural Information

Molecular Formula

C₁₀H₁₀N₂

SMILES

C1CC1C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C10H10N2/c1-2-4-9-8(3-1)11-10(12-9)7-5-6-7/h1-4,7H,5-6H2,(H,11,12)

InChIKey

ACQZKAMBZDAMRZ-UHFFFAOYSA-N

Compound name

2-cyclopropyl-1H-benzimidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 10
References: 85
Patents: 158.0844 Da
Monoisotopic Mass: 2.3
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]+	159.09168	135.3
[M+Na]+	181.07362	150.9
[M+NH4]+	176.11822	145.4
[M+K]+	197.04756	146.4
[M-H]-	157.07712	145.1
[M+Na-2H]-	179.05907	145.9
[M]+	158.08385	141.5
[M]-	158.08495	141.5

Literature stripe

literature stripe

Patent stripe

patents stripe