CID 69740

2-(2-ethenylphenyl)pyridine

Structural Information

Molecular Formula
C13H11N
SMILES
C=CC1=CC=CC=C1C2=CC=CC=N2
InChI
InChI=1S/C13H11N/c1-2-11-7-3-4-8-12(11)13-9-5-6-10-14-13/h2-10H,1H2
InChIKey
JXMVSGDHAJYYOB-UHFFFAOYSA-N
Compound name
2-(2-ethenylphenyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

181.08914 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.096416 137.9
[M+Na]+ 204.078358 146.3
[M-H]- 180.081864 143.3
[M+NH4]+ 199.122963 156.4
[M+K]+ 220.052298 141.9
[M+H-H2O]+ 164.086400 130.3
[M+HCOO]- 226.087341 161.6
[M+CH3COO]- 240.102991 151.4
[M+Na-2H]- 202.063806 146.1
[M]+ 181.08859142 136.8
[M]- 181.08968858 136.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe