CID 5374802

1,2-di(2-pyridyl)ethylene

Structural Information

Molecular Formula
C12H10N2
SMILES
C1=CC=NC(=C1)/C=C/C2=CC=CC=N2
InChI
InChI=1S/C12H10N2/c1-3-9-13-11(5-1)7-8-12-6-2-4-10-14-12/h1-10H/b8-7+
InChIKey
HKEOCEQLCZEBMK-BQYQJAHWSA-N
Compound name
2-[(E)-2-pyridin-2-ylethenyl]pyridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

1031
Patents

182.0844 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[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
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe