CID 264153

14003-37-3

Structural Information

Molecular Formula

C₁₁H₁₀N₂O₂

SMILES

CC(=O)CC1=NC2=CC=CC=C2NC1=O

InChI

InChI=1S/C11H10N2O2/c1-7(14)6-10-11(15)13-9-5-3-2-4-8(9)12-10/h2-5H,6H2,1H3,(H,13,15)

InChIKey

UVTUSDIBTPDTDI-UHFFFAOYSA-N

Compound name

3-(2-oxopropyl)-1H-quinoxalin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 202.07423 Da
Monoisotopic Mass: 0.5
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]+	203.08151	142.2
[M+Na]+	225.06345	156.3
[M+NH4]+	220.10805	149.6
[M+K]+	241.03739	150.1
[M-H]-	201.06695	142.9
[M+Na-2H]-	223.04890	148.5
[M]+	202.07368	144.3
[M]-	202.07478	144.3

Literature stripe

literature stripe

Patent stripe

patents stripe