CID 13804281

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

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

4
Patents

126.04293 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.050206 122.0
[M+Na]+ 149.032148 130.1
[M-H]- 125.035654 125.3
[M+NH4]+ 144.076753 142.8
[M+K]+ 165.006088 131.1
[M+H-H2O]+ 109.040190 115.8
[M+HCOO]- 171.041131 147.0
[M+CH3COO]- 185.056781 170.0
[M+Na-2H]- 147.017596 129.9
[M]+ 126.04238142 122.8
[M]- 126.04347858 122.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe