CID 95009

48152-09-6

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₂

SMILES

C1COCCN1CCCN2CCOCC2

InChI

InChI=1S/C11H22N2O2/c1(2-12-4-8-14-9-5-12)3-13-6-10-15-11-7-13/h1-11H2

InChIKey

PENRYFPQHOTBJV-UHFFFAOYSA-N

Compound name

4-(3-morpholin-4-ylpropyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 88
Patents: 214.16812 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]+	215.175396	152.4
[M+Na]+	237.157338	154.1
[M-H]-	213.160844	155.1
[M+NH4]+	232.201943	164.5
[M+K]+	253.131278	154.9
[M+H-H2O]+	197.165380	143.0
[M+HCOO]-	259.166321	164.9
[M+CH3COO]-	273.181971	184.8
[M+Na-2H]-	235.142786	157.1
[M]+	214.16757142	146.8
[M]-	214.16866858	146.8

Literature stripe

literature stripe

Patent stripe

patents stripe