CID 12279833

61941-79-5

Structural Information

Molecular Formula
C6H7NO2
SMILES
COC1=CNC(=O)C=C1
InChI
InChI=1S/C6H7NO2/c1-9-5-2-3-6(8)7-4-5/h2-4H,1H3,(H,7,8)
InChIKey
OLQMORKJFAJCAT-UHFFFAOYSA-N
Compound name
5-methoxy-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

187
Patents

125.047676 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.054952 120.1
[M+Na]+ 148.036894 129.6
[M-H]- 124.040400 121.7
[M+NH4]+ 143.081499 140.6
[M+K]+ 164.010834 127.9
[M+H-H2O]+ 108.044936 114.5
[M+HCOO]- 170.045877 143.6
[M+CH3COO]- 184.061527 166.5
[M+Na-2H]- 146.022342 128.8
[M]+ 125.04712742 120.1
[M]- 125.04822458 120.1
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

patents stripe