CID 10953512

1,5-dihydroxypyridin-2-one

Structural Information

Molecular Formula
C5H5NO3
SMILES
C1=CC(=O)N(C=C1O)O
InChI
InChI=1S/C5H5NO3/c7-4-1-2-5(8)6(9)3-4/h1-3,7,9H
InChIKey
QCOPITRYORSBEW-UHFFFAOYSA-N
Compound name
1,5-dihydroxypyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

127.02694 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.034216 119.0
[M+Na]+ 150.016158 129.3
[M-H]- 126.019664 119.7
[M+NH4]+ 145.060763 138.9
[M+K]+ 165.990098 127.4
[M+H-H2O]+ 110.024200 113.8
[M+HCOO]- 172.025141 141.4
[M+CH3COO]- 186.040791 164.2
[M+Na-2H]- 148.001606 126.9
[M]+ 127.02639142 118.6
[M]- 127.02748858 118.6
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