CID 220017

5342-23-4

Structural Information

Molecular Formula

C₁₁H₁₁NO₂

SMILES

CC1=CC(=O)NC2=C1C=C(C=C2)OC

InChI

InChI=1S/C11H11NO2/c1-7-5-11(13)12-10-4-3-8(14-2)6-9(7)10/h3-6H,1-2H3,(H,12,13)

InChIKey

VGQWDNJRHAWUNX-UHFFFAOYSA-N

Compound name

6-methoxy-4-methyl-1H-quinolin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 29
Patents: 189.07898 Da
Monoisotopic Mass: 1.2
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	138.1
[M+Na]+	212.06820	153.2
[M+NH4]+	207.11280	146.8
[M+K]+	228.04214	146.1
[M-H]-	188.07170	140.3
[M+Na-2H]-	210.05365	145.2
[M]+	189.07843	140.9
[M]-	189.07953	140.9

Literature stripe

literature stripe

Patent stripe

patents stripe