CID 22215

Linadryl

Structural Information

Molecular Formula

C₁₉H₂₃NO₂

SMILES

C1COCCN1CCOC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

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

InChIKey

MJPJBBIHDOFGDK-UHFFFAOYSA-N

Compound name

4-(2-benzhydryloxyethyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 297.17288 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]+	298.180156	171.5
[M+Na]+	320.162098	173.7
[M-H]-	296.165604	178.4
[M+NH4]+	315.206703	182.5
[M+K]+	336.136038	171.0
[M+H-H2O]+	280.170140	161.0
[M+HCOO]-	342.171081	188.2
[M+CH3COO]-	356.186731	180.7
[M+Na-2H]-	318.147546	175.7
[M]+	297.17233142	168.4
[M]-	297.17342858	168.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.