CID 54712720

4-hydroxy-6,7-dimethoxyquinolin-2(1h)-one

Structural Information

Molecular Formula

C₁₁H₁₁NO₄

SMILES

COC1=C(C=C2C(=C1)C(=CC(=O)N2)O)OC

InChI

InChI=1S/C11H11NO4/c1-15-9-3-6-7(4-10(9)16-2)12-11(14)5-8(6)13/h3-5H,1-2H3,(H2,12,13,14)

InChIKey

FGPCWYCOKWFRNK-UHFFFAOYSA-N

Compound name

4-hydroxy-6,7-dimethoxy-1H-quinolin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 221.0688 Da
Monoisotopic Mass: 0.6
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]+	222.076076	143.8
[M+Na]+	244.058018	154.6
[M-H]-	220.061524	145.5
[M+NH4]+	239.102623	161.3
[M+K]+	260.031958	151.3
[M+H-H2O]+	204.066060	137.6
[M+HCOO]-	266.067001	164.3
[M+CH3COO]-	280.082651	184.7
[M+Na-2H]-	242.043466	150.6
[M]+	221.06825142	146.8
[M]-	221.06934858	146.8

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.