CID 9837924

173604-33-6

Structural Information

Molecular Formula

C₁₆H₁₅NO₂

SMILES

C1[C@H](NC(=O)O1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H15NO2/c18-16-17-14(11-19-16)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14-15H,11H2,(H,17,18)/t14-/m0/s1

InChIKey

QEOCTJMBYZNEJH-AWEZNQCLSA-N

Compound name

(4R)-4-benzhydryl-1,3-oxazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 49
Patents: 253.11028 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]+	254.11756	157.1
[M+Na]+	276.09950	162.6
[M-H]-	252.10300	164.4
[M+NH4]+	271.14410	171.6
[M+K]+	292.07344	159.1
[M+H-H2O]+	236.10754	148.8
[M+HCOO]-	298.10848	176.0
[M+CH3COO]-	312.12413	168.4
[M+Na-2H]-	274.08495	160.1
[M]+	253.10973	153.4
[M]-	253.11083	153.4

Literature stripe

literature stripe

Patent stripe

patents stripe