CID 135926892

5-(1,3,4-oxadiazol-2-yl)-1,2-dihydropyridin-2-one

Structural Information

Molecular Formula
C7H5N3O2
SMILES
C1=CC(=O)NC=C1C2=NN=CO2
InChI
InChI=1S/C7H5N3O2/c11-6-2-1-5(3-8-6)7-10-9-4-12-7/h1-4H,(H,8,11)
InChIKey
IHIZAFFHUCXEEG-UHFFFAOYSA-N
Compound name
5-(1,3,4-oxadiazol-2-yl)-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.03818 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04546 128.7
[M+Na]+ 186.02740 139.1
[M-H]- 162.03090 131.4
[M+NH4]+ 181.07200 144.9
[M+K]+ 202.00134 137.1
[M+H-H2O]+ 146.03544 120.6
[M+HCOO]- 208.03638 150.3
[M+CH3COO]- 222.05203 142.5
[M+Na-2H]- 184.01285 137.1
[M]+ 163.03763 128.8
[M]- 163.03873 128.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.