CID 208587

32525-40-9

Structural Information

Molecular Formula

C₁₉H₂₁NO₂

SMILES

C1COCCN1CC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21NO2/c21-19(17-9-5-2-6-10-17)18(16-7-3-1-4-8-16)15-20-11-13-22-14-12-20/h1-10,18H,11-15H2

InChIKey

MFEJFAWVQXBYRU-UHFFFAOYSA-N

Compound name

3-morpholin-4-yl-1,2-diphenylpropan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 295.15723 Da
Monoisotopic Mass: 2.9
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]+	296.164506	170.7
[M+Na]+	318.146448	172.9
[M-H]-	294.149954	177.7
[M+NH4]+	313.191053	181.5
[M+K]+	334.120388	170.1
[M+H-H2O]+	278.154490	160.4
[M+HCOO]-	340.155431	186.6
[M+CH3COO]-	354.171081	179.8
[M+Na-2H]-	316.131896	173.7
[M]+	295.15668142	166.3
[M]-	295.15777858	166.3

Literature stripe

literature stripe

Patent stripe

patents stripe