CID 19004505

2-(quinolin-4-yloxy)ethan-1-ol

Structural Information

Molecular Formula

C₁₁H₁₁NO₂

SMILES

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

InChI

InChI=1S/C11H11NO2/c13-7-8-14-11-5-6-12-10-4-2-1-3-9(10)11/h1-6,13H,7-8H2

InChIKey

YNLWMAAGRSJGCB-UHFFFAOYSA-N

Compound name

2-quinolin-4-yloxyethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 9
Patents: 189.07898 Da
Monoisotopic Mass: 0.2
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]+	190.08626	138.3
[M+Na]+	212.06820	146.8
[M-H]-	188.07170	140.2
[M+NH4]+	207.11280	157.1
[M+K]+	228.04214	143.6
[M+H-H2O]+	172.07624	131.5
[M+HCOO]-	234.07718	159.8
[M+CH3COO]-	248.09283	180.0
[M+Na-2H]-	210.05365	147.7
[M]+	189.07843	139.6
[M]-	189.07953	139.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe