CID 2772787

57262-39-2

Structural Information

Molecular Formula

C₁₀H₁₃N₃O

SMILES

CN1C2=CC=CC=C2N=C1NCCO

InChI

InChI=1S/C10H13N3O/c1-13-9-5-3-2-4-8(9)12-10(13)11-6-7-14/h2-5,14H,6-7H2,1H3,(H,11,12)

InChIKey

AGVCWRQUNMNVHV-UHFFFAOYSA-N

Compound name

2-[(1-methylbenzimidazol-2-yl)amino]ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 3
References: 6
Patents: 191.10587 Da
Monoisotopic Mass: 0.9
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]+	192.11315	139.9
[M+Na]+	214.09509	152.5
[M+NH4]+	209.13969	147.9
[M+K]+	230.06903	147.9
[M-H]-	190.09859	141.3
[M+Na-2H]-	212.08054	146.1
[M]+	191.10532	141.9
[M]-	191.10642	141.9

Literature stripe

literature stripe

Patent stripe

patents stripe