CID 11762

1,1'-bi-2-naphthol

Structural Information

Molecular Formula

C₂₀H₁₄O₂

SMILES

C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O

InChI

InChI=1S/C20H14O2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12,21-22H

InChIKey

PPTXVXKCQZKFBN-UHFFFAOYSA-N

Compound name

1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 160
References: 13740
Patents: 286.09937 Da
Monoisotopic Mass: 5.3
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]+	287.106646	164.3
[M+Na]+	309.088588	174.6
[M-H]-	285.092094	171.1
[M+NH4]+	304.133193	180.8
[M+K]+	325.062528	167.5
[M+H-H2O]+	269.096630	156.3
[M+HCOO]-	331.097571	184.7
[M+CH3COO]-	345.113221	176.3
[M+Na-2H]-	307.074036	172.5
[M]+	286.09882142	164.9
[M]-	286.09991858	164.9

Literature stripe

literature stripe

Patent stripe

patents stripe