CID 6141586

4-styrylnicotinamide

Structural Information

Molecular Formula

C₁₄H₁₂N₂O

SMILES

C1=CC=C(C=C1)/C=C/C2=C(C=NC=C2)C(=O)N

InChI

InChI=1S/C14H12N2O/c15-14(17)13-10-16-9-8-12(13)7-6-11-4-2-1-3-5-11/h1-10H,(H2,15,17)/b7-6+

InChIKey

NJYVZKYKDVQUAH-VOTSOKGWSA-N

Compound name

4-[(E)-2-phenylethenyl]pyridine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 224.09496 Da
Monoisotopic Mass: 2.0
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]+	225.10224	151.1
[M+Na]+	247.08418	165.0
[M+NH4]+	242.12878	159.0
[M+K]+	263.05812	157.4
[M-H]-	223.08768	155.3
[M+Na-2H]-	245.06963	160.4
[M]+	224.09441	154.2
[M]-	224.09551	154.2

Literature stripe

literature stripe

Patent stripe

patents stripe