CID 11322747

282735-66-4

Structural Information

Molecular Formula

C₁₆H₁₅NO₂

SMILES

C1C(=O)O[C@H]([C@H](N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H15NO2/c18-14-11-17-15(12-7-3-1-4-8-12)16(19-14)13-9-5-2-6-10-13/h1-10,15-17H,11H2/t15-,16+/m1/s1

InChIKey

LTPOSIZJPSDSIL-CVEARBPZSA-N

Compound name

(5R,6S)-5,6-diphenylmorpholin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 142
Patents: 253.11028 Da
Monoisotopic Mass: 2.5
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]+	254.11756	157.6
[M+Na]+	276.09950	163.4
[M-H]-	252.10300	164.6
[M+NH4]+	271.14410	170.4
[M+K]+	292.07344	159.3
[M+H-H2O]+	236.10754	148.4
[M+HCOO]-	298.10848	175.2
[M+CH3COO]-	312.12413	168.4
[M+Na-2H]-	274.08495	162.8
[M]+	253.10973	152.5
[M]-	253.11083	152.5

Literature stripe

literature stripe

Patent stripe

patents stripe