CID 37204

N-(5,6-dimethyl-1h-benzimidazol-2-yl)acetamide

Structural Information

Molecular Formula

C₁₁H₁₃N₃O

SMILES

CC1=CC2=C(C=C1C)N=C(N2)NC(=O)C

InChI

InChI=1S/C11H13N3O/c1-6-4-9-10(5-7(6)2)14-11(13-9)12-8(3)15/h4-5H,1-3H3,(H2,12,13,14,15)

InChIKey

PPNFSQZQTMXUFA-UHFFFAOYSA-N

Compound name

N-(5,6-dimethyl-1H-benzimidazol-2-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 4
Patents: 203.10587 Da
Monoisotopic Mass: 1.8
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]+	204.11315	144.2
[M+Na]+	226.09509	156.7
[M+NH4]+	221.13969	151.6
[M+K]+	242.06903	152.7
[M-H]-	202.09859	145.2
[M+Na-2H]-	224.08054	149.4
[M]+	203.10532	146.0
[M]-	203.10642	146.0

Literature stripe

literature stripe

Patent stripe

patents stripe