CID 10331015

66416-75-9

Structural Information

Molecular Formula

C₁₁H₉NO₄

SMILES

COC(=O)C1=CC(=O)NC2=C1C=C(C=C2)O

InChI

InChI=1S/C11H9NO4/c1-16-11(15)8-5-10(14)12-9-3-2-6(13)4-7(8)9/h2-5,13H,1H3,(H,12,14)

InChIKey

VMFVSNYOKIVXJO-UHFFFAOYSA-N

Compound name

methyl 6-hydroxy-2-oxo-1H-quinoline-4-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 219.05316 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]+	220.06044	142.9
[M+Na]+	242.04238	152.9
[M-H]-	218.04588	144.3
[M+NH4]+	237.08698	160.1
[M+K]+	258.01632	149.4
[M+H-H2O]+	202.05042	136.7
[M+HCOO]-	264.05136	162.6
[M+CH3COO]-	278.06701	182.9
[M+Na-2H]-	240.02783	149.2
[M]+	219.05261	144.0
[M]-	219.05371	144.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.