CID 206121

42902-35-2

Structural Information

Molecular Formula

C₁₀H₁₁NO₄

SMILES

C1C(OC(=O)N1C2=CC(=CC=C2)O)CO

InChI

InChI=1S/C10H11NO4/c12-6-9-5-11(10(14)15-9)7-2-1-3-8(13)4-7/h1-4,9,12-13H,5-6H2

InChIKey

AVUYUWXNGHVSBO-UHFFFAOYSA-N

Compound name

5-(hydroxymethyl)-3-(3-hydroxyphenyl)-1,3-oxazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 209.0688 Da
Monoisotopic Mass: 0.5
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]+	210.076076	142.3
[M+Na]+	232.058018	150.5
[M-H]-	208.061524	146.1
[M+NH4]+	227.102623	159.0
[M+K]+	248.031958	148.7
[M+H-H2O]+	192.066060	136.0
[M+HCOO]-	254.067001	161.7
[M+CH3COO]-	268.082651	179.2
[M+Na-2H]-	230.043466	145.9
[M]+	209.06825142	141.5
[M]-	209.06934858	141.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe