CID 15656133

16952-66-2

Structural Information

Molecular Formula

C₈H₁₀N₂O₂

SMILES

CCOC(=O)C1=C(C=CN=C1)N

InChI

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

InChIKey

YTLWFCDPORJXPP-UHFFFAOYSA-N

Compound name

ethyl 4-aminopyridine-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 49
Patents: 166.07423 Da
Monoisotopic Mass: 0.9
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	133.9
[M+Na]+	189.06345	145.5
[M+NH4]+	184.10805	141.3
[M+K]+	205.03739	140.4
[M-H]-	165.06695	135.2
[M+Na-2H]-	187.04890	140.1
[M]+	166.07368	135.7
[M]-	166.07478	135.7

Literature stripe

literature stripe

Patent stripe

patents stripe