CID 209337

Morpholine, 4-(p-phenoxymethylphenethyl)-

Structural Information

Molecular Formula

C₁₉H₂₃NO₂

SMILES

C1COCCN1CCC2=CC=C(C=C2)COC3=CC=CC=C3

InChI

InChI=1S/C19H23NO2/c1-2-4-19(5-3-1)22-16-18-8-6-17(7-9-18)10-11-20-12-14-21-15-13-20/h1-9H,10-16H2

InChIKey

UCFBSPYKXGMZPT-UHFFFAOYSA-N

Compound name

4-[2-[4-(phenoxymethyl)phenyl]ethyl]morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 297.17288 Da
Monoisotopic Mass: 3.2
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]+	298.180156	171.6
[M+Na]+	320.162098	175.1
[M-H]-	296.165604	178.8
[M+NH4]+	315.206703	183.0
[M+K]+	336.136038	171.9
[M+H-H2O]+	280.170140	161.1
[M+HCOO]-	342.171081	189.4
[M+CH3COO]-	356.186731	181.3
[M+Na-2H]-	318.147546	176.2
[M]+	297.17233142	169.5
[M]-	297.17342858	169.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe