CID 676266

N-(pyridin-4-yl)thiophene-2-carboxamide

Structural Information

Molecular Formula

C₁₀H₈N₂OS

SMILES

C1=CSC(=C1)C(=O)NC2=CC=NC=C2

InChI

InChI=1S/C10H8N2OS/c13-10(9-2-1-7-14-9)12-8-3-5-11-6-4-8/h1-7H,(H,11,12,13)

InChIKey

RKADCAQUGVEIJY-UHFFFAOYSA-N

Compound name

N-pyridin-4-ylthiophene-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 5
Patents: 204.03574 Da
Monoisotopic Mass: 1.7
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]+	205.04302	142.1
[M+Na]+	227.02496	154.0
[M+NH4]+	222.06956	151.1
[M+K]+	242.99890	147.3
[M-H]-	203.02846	146.1
[M+Na-2H]-	225.01041	150.5
[M]+	204.03519	145.3
[M]-	204.03629	145.3

Literature stripe

literature stripe

Patent stripe

patents stripe