CID 80899

6425-08-7

Structural Information

Molecular Formula

C₁₅H₂₂N₂O₂

SMILES

C1COCCN1C(C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C15H22N2O2/c1-2-4-14(5-3-1)15(16-6-10-18-11-7-16)17-8-12-19-13-9-17/h1-5,15H,6-13H2

InChIKey

OXZAQXLHJGERIN-UHFFFAOYSA-N

Compound name

4-[morpholin-4-yl(phenyl)methyl]morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 26
Patents: 262.16812 Da
Monoisotopic Mass: 1.2
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]+	263.17540	162.8
[M+Na]+	285.15734	163.8
[M-H]-	261.16084	168.4
[M+NH4]+	280.20194	172.2
[M+K]+	301.13128	163.3
[M+H-H2O]+	245.16538	151.9
[M+HCOO]-	307.16632	174.2
[M+CH3COO]-	321.18197	171.3
[M+Na-2H]-	283.14279	166.5
[M]+	262.16757	155.2
[M]-	262.16867	155.2

Literature stripe

literature stripe

Patent stripe

patents stripe