CID 54684039

Brn 4315786

Structural Information

Molecular Formula

C₁₁H₁₀N₂O₃

SMILES

CNC(=O)C1=C(C2=CC=CC=C2NC1=O)O

InChI

InChI=1S/C11H10N2O3/c1-12-10(15)8-9(14)6-4-2-3-5-7(6)13-11(8)16/h2-5H,1H3,(H,12,15)(H2,13,14,16)

InChIKey

QATJOQLILULHDL-UHFFFAOYSA-N

Compound name

4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 2
Patents: 218.06914 Da
Monoisotopic Mass: 1.3
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]+	219.07642	145.1
[M+Na]+	241.05836	157.5
[M+NH4]+	236.10296	151.9
[M+K]+	257.03230	152.4
[M-H]-	217.06186	145.9
[M+Na-2H]-	239.04381	150.2
[M]+	218.06859	146.8
[M]-	218.06969	146.8

Literature stripe

literature stripe

Patent stripe

patents stripe