CID 13804281

108512-00-1

Structural Information

Molecular Formula

C₅H₆N₂O₂

SMILES

CC(=O)NC1=CON=C1

InChI

InChI=1S/C5H6N2O2/c1-4(8)7-5-2-6-9-3-5/h2-3H,1H3,(H,7,8)

InChIKey

RPMDGHXXKRVQMU-UHFFFAOYSA-N

Compound name

N-(1,2-oxazol-4-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 126.04293 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]+	127.05021	123.0
[M+Na]+	149.03215	133.4
[M+NH4]+	144.07675	130.5
[M+K]+	165.00609	131.2
[M-H]-	125.03565	124.8
[M+Na-2H]-	147.01760	128.2
[M]+	126.04238	124.6
[M]-	126.04348	124.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.