CID 339524

Nsc366404

Structural Information

Molecular Formula

C₁₁H₁₂N₂O

SMILES

CN(C)C1=CC2=C(C=C1)C=CC(=O)N2

InChI

InChI=1S/C11H12N2O/c1-13(2)9-5-3-8-4-6-11(14)12-10(8)7-9/h3-7H,1-2H3,(H,12,14)

InChIKey

QINHKEKBELKERL-UHFFFAOYSA-N

Compound name

7-(dimethylamino)-1H-quinolin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 15
Patents: 188.09496 Da
Monoisotopic Mass: 1.4
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]+	189.10224	138.0
[M+Na]+	211.08418	147.1
[M-H]-	187.08768	141.8
[M+NH4]+	206.12878	157.5
[M+K]+	227.05812	144.0
[M+H-H2O]+	171.09222	131.2
[M+HCOO]-	233.09316	161.0
[M+CH3COO]-	247.10881	186.6
[M+Na-2H]-	209.06963	146.3
[M]+	188.09441	138.1
[M]-	188.09551	138.1

Literature stripe

literature stripe

Patent stripe

patents stripe