CID 641098

4-styrylpyridine

Structural Information

Molecular Formula
C13H11N
SMILES
C1=CC=C(C=C1)/C=C/C2=CC=NC=C2
InChI
InChI=1S/C13H11N/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13/h1-11H/b7-6+
InChIKey
QKHRGPYNTXRMSL-VOTSOKGWSA-N
Compound name
4-[(E)-2-phenylethenyl]pyridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

21
References

260
Patents

181.08914 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.09642 140.1
[M+Na]+ 204.07836 156.3
[M+NH4]+ 199.12296 150.0
[M+K]+ 220.05230 146.8
[M-H]- 180.08186 145.3
[M+Na-2H]- 202.06381 151.7
[M]+ 181.08859 144.1
[M]- 181.08969 144.1
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