CID 43654653

2-(3-hydroxyphenyl)-3,4-dihydropyrimidin-4-one

Structural Information

Molecular Formula
C10H8N2O2
SMILES
C1=CC(=CC(=C1)O)C2=NC=CC(=O)N2
InChI
InChI=1S/C10H8N2O2/c13-8-3-1-2-7(6-8)10-11-5-4-9(14)12-10/h1-6,13H,(H,11,12,14)
InChIKey
AHJODUGRMODXIX-UHFFFAOYSA-N
Compound name
2-(3-hydroxyphenyl)-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.05858 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.065856 137.6
[M+Na]+ 211.047798 147.3
[M-H]- 187.051304 139.7
[M+NH4]+ 206.092403 153.2
[M+K]+ 227.021738 142.5
[M+H-H2O]+ 171.055840 129.9
[M+HCOO]- 233.056781 158.3
[M+CH3COO]- 247.072431 150.3
[M+Na-2H]- 209.033246 145.6
[M]+ 188.05803142 135.5
[M]- 188.05912858 135.5
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.