CID 593855

2-[(quinolin-2-yl)amino]ethan-1-ol

Structural Information

Molecular Formula

C₁₁H₁₂N₂O

SMILES

C1=CC=C2C(=C1)C=CC(=N2)NCCO

InChI

InChI=1S/C11H12N2O/c14-8-7-12-11-6-5-9-3-1-2-4-10(9)13-11/h1-6,14H,7-8H2,(H,12,13)

InChIKey

MFOKDWUAYVSYHN-UHFFFAOYSA-N

Compound name

2-(quinolin-2-ylamino)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 19
Patents: 188.09496 Da
Monoisotopic Mass: 1.4
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]+	189.10224	139.5
[M+Na]+	211.08418	153.0
[M+NH4]+	206.12878	148.5
[M+K]+	227.05812	145.5
[M-H]-	187.08768	142.5
[M+Na-2H]-	209.06963	147.3
[M]+	188.09441	142.2
[M]-	188.09551	142.2

Literature stripe

literature stripe

Patent stripe

patents stripe