CID 69740

Pyridine, 2-styryl-

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

2
Annotation Hits: 0
References: 58
Patents: 181.08914 Da
Monoisotopic Mass: 3.4
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]+	182.09642	137.9
[M+Na]+	204.07836	146.3
[M-H]-	180.08186	143.3
[M+NH4]+	199.12296	156.4
[M+K]+	220.05230	141.9
[M+H-H2O]+	164.08640	130.3
[M+HCOO]-	226.08734	161.6
[M+CH3COO]-	240.10299	151.4
[M+Na-2H]-	202.06381	146.1
[M]+	181.08859	136.8
[M]-	181.08969	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe