CID 595203

80636-30-2

Structural Information

Molecular Formula

C₁₀H₁₂N₂O

SMILES

CC1(C(=O)NC2=CC=CC=C2N1)C

InChI

InChI=1S/C10H12N2O/c1-10(2)9(13)11-7-5-3-4-6-8(7)12-10/h3-6,12H,1-2H3,(H,11,13)

InChIKey

RDKNTOVJVFYGPA-UHFFFAOYSA-N

Compound name

3,3-dimethyl-1,4-dihydroquinoxalin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 96
Patents: 176.09496 Da
Monoisotopic Mass: 1.5
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]+	177.10224	138.8
[M+Na]+	199.08418	151.7
[M+NH4]+	194.12878	148.4
[M+K]+	215.05812	143.4
[M-H]-	175.08768	139.7
[M+Na-2H]-	197.06963	145.4
[M]+	176.09441	140.9
[M]-	176.09551	140.9

Literature stripe

literature stripe

Patent stripe

patents stripe