CID 2737021

6-morpholinonicotinonitrile

Structural Information

Molecular Formula

C₁₀H₁₁N₃O

SMILES

C1COCCN1C2=NC=C(C=C2)C#N

InChI

InChI=1S/C10H11N3O/c11-7-9-1-2-10(12-8-9)13-3-5-14-6-4-13/h1-2,8H,3-6H2

InChIKey

MWMUIALBOFAVDT-UHFFFAOYSA-N

Compound name

6-morpholin-4-ylpyridine-3-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 37
Patents: 189.09021 Da
Monoisotopic Mass: 0.7
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]+	190.09749	146.2
[M+Na]+	212.07943	159.0
[M+NH4]+	207.12403	151.0
[M+K]+	228.05337	149.3
[M-H]-	188.08293	143.0
[M+Na-2H]-	210.06488	150.8
[M]+	189.08966	146.3
[M]-	189.09076	146.3

Literature stripe

literature stripe

Patent stripe

patents stripe