CID 54684523

4-hydroxy-1-methyl-2-pyridone

Structural Information

Molecular Formula
C6H7NO2
SMILES
CN1C=CC(=CC1=O)O
InChI
InChI=1S/C6H7NO2/c1-7-3-2-5(8)4-6(7)9/h2-4,8H,1H3
InChIKey
ISFRSMMUUQWJCU-UHFFFAOYSA-N
Compound name
4-hydroxy-1-methylpyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

148
Patents

125.047676 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.05495 121.0
[M+Na]+ 148.03689 134.7
[M+NH4]+ 143.08150 129.2
[M+K]+ 164.01083 129.2
[M-H]- 124.04040 122.0
[M+Na-2H]- 146.02234 128.1
[M]+ 125.04713 123.1
[M]- 125.04822 123.1
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