CID 73745

2-naphthalenol, 1-(3-pyridinylazo)-

Structural Information

Molecular Formula

C₁₅H₁₁N₃O

SMILES

C1=CC=C2C(=C1)C=CC(=C2N=NC3=CN=CC=C3)O

InChI

InChI=1S/C15H11N3O/c19-14-8-7-11-4-1-2-6-13(11)15(14)18-17-12-5-3-9-16-10-12/h1-10,19H

InChIKey

TYRCKEFIYKISNH-UHFFFAOYSA-N

Compound name

1-(pyridin-3-yldiazenyl)naphthalen-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 249.09021 Da
Monoisotopic Mass: 3.5
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]+	250.09749	155.0
[M+Na]+	272.07943	170.9
[M+NH4]+	267.12403	164.5
[M+K]+	288.05337	161.8
[M-H]-	248.08293	161.8
[M+Na-2H]-	270.06488	166.4
[M]+	249.08966	159.3
[M]-	249.09076	159.3

Literature stripe

literature stripe

Patent stripe

patents stripe