CID 207654

2(1h)-quinolone, 4-methyl-1-vinyl-

Structural Information

Molecular Formula

C₁₂H₁₁NO

SMILES

CC1=CC(=O)N(C2=CC=CC=C12)C=C

InChI

InChI=1S/C12H11NO/c1-3-13-11-7-5-4-6-10(11)9(2)8-12(13)14/h3-8H,1H2,2H3

InChIKey

CAKYOSQLVGQRCO-UHFFFAOYSA-N

Compound name

1-ethenyl-4-methylquinolin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 185.08406 Da
Monoisotopic Mass: 1.9
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]+	186.09134	136.5
[M+Na]+	208.07328	147.5
[M-H]-	184.07678	140.5
[M+NH4]+	203.11788	156.8
[M+K]+	224.04722	143.3
[M+H-H2O]+	168.08132	130.0
[M+HCOO]-	230.08226	159.3
[M+CH3COO]-	244.09791	184.2
[M+Na-2H]-	206.05873	144.4
[M]+	185.08351	138.0
[M]-	185.08461	138.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.