CID 1811416

3-(4-acetylphenyl)-1,3-oxazolidin-2-one

Structural Information

Molecular Formula

C₁₁H₁₁NO₃

SMILES

CC(=O)C1=CC=C(C=C1)N2CCOC2=O

InChI

InChI=1S/C11H11NO3/c1-8(13)9-2-4-10(5-3-9)12-6-7-15-11(12)14/h2-5H,6-7H2,1H3

InChIKey

NKYZULHJSPVQDR-UHFFFAOYSA-N

Compound name

3-(4-acetylphenyl)-1,3-oxazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 205.0739 Da
Monoisotopic Mass: 1.1
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]+	206.08118	143.5
[M+Na]+	228.06312	155.4
[M+NH4]+	223.10772	150.9
[M+K]+	244.03706	152.3
[M-H]-	204.06662	146.7
[M+Na-2H]-	226.04857	148.9
[M]+	205.07335	145.9
[M]-	205.07445	145.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe