CID 65725

3-amino-2-oxazolidinone

Structural Information

Molecular Formula

C₃H₆N₂O₂

SMILES

C1COC(=O)N1N

InChI

InChI=1S/C3H6N2O2/c4-5-1-2-7-3(5)6/h1-2,4H2

InChIKey

KYCJNIUHWNJNCT-UHFFFAOYSA-N

Compound name

3-amino-1,3-oxazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 56
References: 384
Patents: 102.04293 Da
Monoisotopic Mass: -0.8
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]+	103.05021	115.7
[M+Na]+	125.03215	123.8
[M-H]-	101.03565	118.3
[M+NH4]+	120.07675	137.4
[M+K]+	141.00609	124.8
[M+H-H2O]+	85.040190	110.1
[M+HCOO]-	147.04113	138.8
[M+CH3COO]-	161.05678	164.9
[M+Na-2H]-	123.01760	122.2
[M]+	102.04238	113.1
[M]-	102.04348	113.1

Literature stripe

literature stripe

Patent stripe

patents stripe