CID 6303920

Trans-2,4'-vinylenedipyridine

Structural Information

Molecular Formula

C₁₂H₁₀N₂

SMILES

C1=CC=NC(=C1)/C=C/C2=CC=NC=C2

InChI

InChI=1S/C12H10N2/c1-2-8-14-12(3-1)5-4-11-6-9-13-10-7-11/h1-10H/b5-4+

InChIKey

RETWYDZOYDJBIX-SNAWJCMRSA-N

Compound name

2-[(E)-2-pyridin-4-ylethenyl]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 27
Patents: 182.0844 Da
Monoisotopic Mass: 2.1
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]+	183.09168	138.6
[M+Na]+	205.07362	146.6
[M-H]-	181.07712	142.3
[M+NH4]+	200.11822	155.4
[M+K]+	221.04756	142.1
[M+H-H2O]+	165.08166	129.9
[M+HCOO]-	227.08260	161.2
[M+CH3COO]-	241.09825	151.4
[M+Na-2H]-	203.05907	148.1
[M]+	182.08385	137.2
[M]-	182.08495	137.2

Literature stripe

literature stripe

Patent stripe

patents stripe