CID 265830

8-hydroxy-7-quinolinecarboxaldehyde

Structural Information

Molecular Formula

C₁₀H₇NO₂

SMILES

C1=CC2=C(C(=C(C=C2)C=O)O)N=C1

InChI

InChI=1S/C10H7NO2/c12-6-8-4-3-7-2-1-5-11-9(7)10(8)13/h1-6,13H

InChIKey

HGNLFMRNEFPDHZ-UHFFFAOYSA-N

Compound name

8-hydroxyquinoline-7-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 72
Patents: 173.04768 Da
Monoisotopic Mass: 1.8
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]+	174.054956	132.3
[M+Na]+	196.036898	142.5
[M-H]-	172.040404	134.9
[M+NH4]+	191.081503	152.0
[M+K]+	212.010838	139.0
[M+H-H2O]+	156.044940	126.1
[M+HCOO]-	218.045881	154.4
[M+CH3COO]-	232.061531	177.3
[M+Na-2H]-	194.022346	141.6
[M]+	173.04713142	133.0
[M]-	173.04822858	133.0

Literature stripe

literature stripe

Patent stripe

patents stripe