CID 315482

3-hydroxy-2-naphthaldehyde

Structural Information

Molecular Formula

C₁₁H₈O₂

SMILES

C1=CC=C2C=C(C(=CC2=C1)C=O)O

InChI

InChI=1S/C11H8O2/c12-7-10-5-8-3-1-2-4-9(8)6-11(10)13/h1-7,13H

InChIKey

QCUNDLUTTXSPFM-UHFFFAOYSA-N

Compound name

3-hydroxynaphthalene-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 4
References: 1355
Patents: 172.05243 Da
Monoisotopic Mass: 2.8
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]+	173.05971	133.0
[M+Na]+	195.04165	148.0
[M+NH4]+	190.08625	142.6
[M+K]+	211.01559	140.5
[M-H]-	171.04515	136.0
[M+Na-2H]-	193.02710	140.9
[M]+	172.05188	136.0
[M]-	172.05298	136.0

Literature stripe

literature stripe

Patent stripe

patents stripe