CID 10923604

136465-99-1

Structural Information

Molecular Formula

C₁₄H₁₀N₂O₄

SMILES

C1CC(=O)N(C1=O)OC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C14H10N2O4/c17-12-7-8-13(18)16(12)20-14(19)11-6-5-9-3-1-2-4-10(9)15-11/h1-6H,7-8H2

InChIKey

IMTUBZOIPOXUTD-UHFFFAOYSA-N

Compound name

(2,5-dioxopyrrolidin-1-yl) quinoline-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 133
Patents: 270.06406 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]+	271.07134	158.9
[M+Na]+	293.05328	171.4
[M+NH4]+	288.09788	165.5
[M+K]+	309.02722	167.7
[M-H]-	269.05678	160.4
[M+Na-2H]-	291.03873	164.2
[M]+	270.06351	160.8
[M]-	270.06461	160.8

Literature stripe

literature stripe

Patent stripe

patents stripe