CID 5475238

Naphthylvinylpyridine

Structural Information

Molecular Formula

C₁₇H₁₃N

SMILES

C1=CC=C2C(=C1)C=CC=C2/C=C/C3=CC=NC=C3

InChI

InChI=1S/C17H13N/c1-2-7-17-15(4-1)5-3-6-16(17)9-8-14-10-12-18-13-11-14/h1-13H/b9-8+

InChIKey

FLKDRTOVVLNOLV-CMDGGOBGSA-N

Compound name

4-[(E)-2-naphthalen-1-ylethenyl]pyridine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 34
References: 176
Patents: 231.1048 Da
Monoisotopic Mass: 4.4
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]+	232.11208	152.0
[M+Na]+	254.09402	160.2
[M-H]-	230.09752	157.9
[M+NH4]+	249.13862	169.2
[M+K]+	270.06796	153.8
[M+H-H2O]+	214.10206	143.3
[M+HCOO]-	276.10300	174.0
[M+CH3COO]-	290.11865	164.3
[M+Na-2H]-	252.07947	161.0
[M]+	231.10425	150.8
[M]-	231.10535	150.8

Literature stripe

literature stripe

Patent stripe

patents stripe