CID 20786326

N-(4-methylpyridin-3-yl)acetamide

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

CC1=C(C=NC=C1)NC(=O)C

InChI

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

InChIKey

WRPYDRDMRXJIJA-UHFFFAOYSA-N

Compound name

N-(4-methylpyridin-3-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 98
Patents: 150.07932 Da
Monoisotopic Mass: 0.4
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]+	151.08660	130.7
[M+Na]+	173.06854	143.1
[M+NH4]+	168.11314	138.9
[M+K]+	189.04248	137.3
[M-H]-	149.07204	132.7
[M+Na-2H]-	171.05399	137.9
[M]+	150.07877	132.9
[M]-	150.07987	132.9

Literature stripe

literature stripe

Patent stripe

patents stripe