CID 3046889

62825-88-1

Structural Information

Molecular Formula

C₁₀H₁₀ClNO₂

SMILES

C1C(OC(=O)N1)CC2=CC=CC=C2Cl

InChI

InChI=1S/C10H10ClNO2/c11-9-4-2-1-3-7(9)5-8-6-12-10(13)14-8/h1-4,8H,5-6H2,(H,12,13)

InChIKey

PCOMYIUSMUMECB-UHFFFAOYSA-N

Compound name

5-[(2-chlorophenyl)methyl]-1,3-oxazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 211.04001 Da
Monoisotopic Mass: 2.4
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]+	212.04729	143.7
[M+Na]+	234.02923	152.4
[M-H]-	210.03273	148.2
[M+NH4]+	229.07383	161.7
[M+K]+	250.00317	148.5
[M+H-H2O]+	194.03727	137.6
[M+HCOO]-	256.03821	159.4
[M+CH3COO]-	270.05386	179.9
[M+Na-2H]-	232.01468	147.6
[M]+	211.03946	143.3
[M]-	211.04056	143.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe