CID 2776568

2-morpholinonicotinic acid

Structural Information

Molecular Formula

C₁₀H₁₂N₂O₃

SMILES

C1COCCN1C2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C10H12N2O3/c13-10(14)8-2-1-3-11-9(8)12-4-6-15-7-5-12/h1-3H,4-7H2,(H,13,14)

InChIKey

YDUPMJIUJMCXAL-UHFFFAOYSA-N

Compound name

2-morpholin-4-ylpyridine-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 180
Patents: 208.0848 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]+	209.09208	145.0
[M+Na]+	231.07402	157.1
[M+NH4]+	226.11862	151.9
[M+K]+	247.04796	152.5
[M-H]-	207.07752	147.9
[M+Na-2H]-	229.05947	151.0
[M]+	208.08425	147.3
[M]-	208.08535	147.3

Literature stripe

literature stripe

Patent stripe

patents stripe