CID 97126

16722-41-1

Structural Information

Molecular Formula

C₁₅H₁₁N₃

SMILES

C1=CC=C2C(=C1)C=C(C=N2)N=CC3=CC=CC=N3

InChI

InChI=1S/C15H11N3/c1-2-7-15-12(5-1)9-14(11-18-15)17-10-13-6-3-4-8-16-13/h1-11H

InChIKey

VSXVCNZQHCSOQQ-UHFFFAOYSA-N

Compound name

1-pyridin-2-yl-N-quinolin-3-ylmethanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 233.09529 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]+	234.10257	151.0
[M+Na]+	256.08451	159.5
[M-H]-	232.08801	157.0
[M+NH4]+	251.12911	167.1
[M+K]+	272.05845	154.2
[M+H-H2O]+	216.09255	141.0
[M+HCOO]-	278.09349	174.8
[M+CH3COO]-	292.10914	163.5
[M+Na-2H]-	254.06996	162.1
[M]+	233.09474	150.8
[M]-	233.09584	150.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe