CID 21750497

2-(pyridin-4-yl)morpholine dihydrochloride

Structural Information

Molecular Formula

C₉H₁₂N₂O

SMILES

C1COC(CN1)C2=CC=NC=C2

InChI

InChI=1S/C9H12N2O/c1-3-10-4-2-8(1)9-7-11-5-6-12-9/h1-4,9,11H,5-7H2

InChIKey

GFTUMNQJJFHZIQ-UHFFFAOYSA-N

Compound name

2-pyridin-4-ylmorpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 53
Patents: 164.09496 Da
Monoisotopic Mass: 0.0
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]+	165.10224	134.7
[M+Na]+	187.08418	140.1
[M-H]-	163.08768	137.0
[M+NH4]+	182.12878	149.9
[M+K]+	203.05812	138.2
[M+H-H2O]+	147.09222	126.4
[M+HCOO]-	209.09316	151.6
[M+CH3COO]-	223.10881	146.2
[M+Na-2H]-	185.06963	142.7
[M]+	164.09441	128.9
[M]-	164.09551	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe