CID 14935881

2-chloro-5,8-dimethoxyquinoline

Structural Information

Molecular Formula

C₁₁H₁₀ClNO₂

SMILES

COC1=C2C=CC(=NC2=C(C=C1)OC)Cl

InChI

InChI=1S/C11H10ClNO2/c1-14-8-4-5-9(15-2)11-7(8)3-6-10(12)13-11/h3-6H,1-2H3

InChIKey

MPEMEHFDNKQRRM-UHFFFAOYSA-N

Compound name

2-chloro-5,8-dimethoxyquinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 223.04001 Da
Monoisotopic Mass: 3.1
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]+	224.04729	143.3
[M+Na]+	246.02923	159.8
[M+NH4]+	241.07383	152.9
[M+K]+	262.00317	151.6
[M-H]-	222.03273	146.3
[M+Na-2H]-	244.01468	151.3
[M]+	223.03946	147.0
[M]-	223.04056	147.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe