CID 730934

6-ethoxy-2-methylquinolin-4-ol

Structural Information

Molecular Formula

C₁₂H₁₃NO₂

SMILES

CCOC1=CC2=C(C=C1)NC(=CC2=O)C

InChI

InChI=1S/C12H13NO2/c1-3-15-9-4-5-11-10(7-9)12(14)6-8(2)13-11/h4-7H,3H2,1-2H3,(H,13,14)

InChIKey

XRQJZFPDCHMABR-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 9
References: 5
Patents: 203.09464 Da
Monoisotopic Mass: 2.3
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]+	204.10192	142.7
[M+Na]+	226.08386	157.6
[M+NH4]+	221.12846	151.2
[M+K]+	242.05780	150.3
[M-H]-	202.08736	144.8
[M+Na-2H]-	224.06931	149.5
[M]+	203.09409	145.4
[M]-	203.09519	145.4

Literature stripe

literature stripe

Patent stripe

patents stripe