CID 5374801

1-(2-pyridyl)-2-(3-pyridyl)-ethylene

Structural Information

Molecular Formula

C₁₂H₁₀N₂

SMILES

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

InChI

InChI=1S/C12H10N2/c1-2-9-14-12(5-1)7-6-11-4-3-8-13-10-11/h1-10H/b7-6+

InChIKey

AUXDIUGCNUFQEM-VOTSOKGWSA-N

Compound name

2-[(E)-2-pyridin-3-ylethenyl]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 10
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]+	183.091676	138.6
[M+Na]+	205.073618	146.6
[M-H]-	181.077124	142.3
[M+NH4]+	200.118223	155.4
[M+K]+	221.047558	142.1
[M+H-H2O]+	165.081660	129.9
[M+HCOO]-	227.082601	161.2
[M+CH3COO]-	241.098251	151.4
[M+Na-2H]-	203.059066	148.1
[M]+	182.08385142	137.2
[M]-	182.08494858	137.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe