CID 3063921

N-ethoxyisonicotinamide hydrochloride

Structural Information

Molecular Formula

C₈H₁₀N₂O₂

SMILES

CCONC(=O)C1=CC=NC=C1

InChI

InChI=1S/C8H10N2O2/c1-2-12-10-8(11)7-3-5-9-6-4-7/h3-6H,2H2,1H3,(H,10,11)

InChIKey

NBHGBTJCQXBTTO-UHFFFAOYSA-N

Compound name

N-ethoxypyridine-4-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 166.07423 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]+	167.08151	134.1
[M+Na]+	189.06345	145.5
[M+NH4]+	184.10805	141.6
[M+K]+	205.03739	140.1
[M-H]-	165.06695	135.4
[M+Na-2H]-	187.04890	141.0
[M]+	166.07368	135.8
[M]-	166.07478	135.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe