CID 120874

4-morpholineethanol, alpha-(2,2-diphenylethyl)-

Structural Information

Molecular Formula

C₂₀H₂₅NO₂

SMILES

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

InChI

InChI=1S/C20H25NO2/c22-19(16-21-11-13-23-14-12-21)15-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,19-20,22H,11-16H2

InChIKey

LUHSBOYBYVJZNU-UHFFFAOYSA-N

Compound name

1-morpholin-4-yl-4,4-diphenylbutan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 311.18854 Da
Monoisotopic Mass: 3.0
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]+	312.195816	176.1
[M+Na]+	334.177758	177.2
[M-H]-	310.181264	181.6
[M+NH4]+	329.222363	185.7
[M+K]+	350.151698	173.9
[M+H-H2O]+	294.185800	165.9
[M+HCOO]-	356.186741	190.0
[M+CH3COO]-	370.202391	184.1
[M+Na-2H]-	332.163206	178.3
[M]+	311.18799142	171.0
[M]-	311.18908858	171.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe