CID 268758

75392-24-4

Structural Information

Molecular Formula

C₂₁H₁₇N

SMILES

C1=CC=C(C=C1)C=CC2=CC(=NC=C2)C=CC3=CC=CC=C3

InChI

InChI=1S/C21H17N/c1-3-7-18(8-4-1)11-12-20-15-16-22-21(17-20)14-13-19-9-5-2-6-10-19/h1-17H

InChIKey

XLHNFKOFFFAZAW-UHFFFAOYSA-N

Compound name

2,4-bis(2-phenylethenyl)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 283.1361 Da
Monoisotopic Mass: 5.4
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]+	284.14338	168.7
[M+Na]+	306.12532	175.3
[M-H]-	282.12882	176.1
[M+NH4]+	301.16992	182.3
[M+K]+	322.09926	167.4
[M+H-H2O]+	266.13336	158.5
[M+HCOO]-	328.13430	190.9
[M+CH3COO]-	342.14995	179.5
[M+Na-2H]-	304.11077	174.7
[M]+	283.13555	166.6
[M]-	283.13665	166.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe