CID 16313

2,4-dichloro-1-naphthol

Structural Information

Molecular Formula

C₁₀H₆Cl₂O

SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C10H6Cl2O/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,13H

InChIKey

HVLJEMXDXOTWLV-UHFFFAOYSA-N

Compound name

2,4-dichloronaphthalen-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 319
Patents: 211.97957 Da
Monoisotopic Mass: 4.8
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]+	212.98685	137.3
[M+Na]+	234.96879	154.6
[M+NH4]+	230.01339	148.1
[M+K]+	250.94273	145.5
[M-H]-	210.97229	140.9
[M+Na-2H]-	232.95424	145.9
[M]+	211.97902	141.6
[M]-	211.98012	141.6

Literature stripe

literature stripe

Patent stripe

patents stripe