CID 76905

2-ethylisonicotinamide

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

CCC1=NC=CC(=C1)C(=O)N

InChI

InChI=1S/C8H10N2O/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11)

InChIKey

LWTBJUQFUISATQ-UHFFFAOYSA-N

Compound name

2-ethylpyridine-4-carboxamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 46
Patents: 150.07932 Da
Monoisotopic Mass: 0.5
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]+	151.08660	130.7
[M+Na]+	173.06854	142.7
[M+NH4]+	168.11314	138.6
[M+K]+	189.04248	137.1
[M-H]-	149.07204	132.4
[M+Na-2H]-	171.05399	137.3
[M]+	150.07877	132.7
[M]-	150.07987	132.7

Literature stripe

literature stripe

Patent stripe

patents stripe