CID 3152379

626209-60-7

Structural Information

Molecular Formula

C₁₂H₁₉N₃O

SMILES

C1COCCN1CCNCC2=CC=NC=C2

InChI

InChI=1S/C12H19N3O/c1-3-13-4-2-12(1)11-14-5-6-15-7-9-16-10-8-15/h1-4,14H,5-11H2

InChIKey

UQENBVFJDLCEFW-UHFFFAOYSA-N

Compound name

2-morpholin-4-yl-N-(pyridin-4-ylmethyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1
Patents: 221.15282 Da
Monoisotopic Mass: -0.1
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]+	222.16010	152.7
[M+Na]+	244.14204	164.4
[M+NH4]+	239.18664	160.6
[M+K]+	260.11598	157.4
[M-H]-	220.14554	157.5
[M+Na-2H]-	242.12749	159.9
[M]+	221.15227	155.5
[M]-	221.15337	155.5

Literature stripe

literature stripe

Patent stripe

patents stripe