CID 111436

68921-95-9

Structural Information

Molecular Formula
C10H10N2O2
SMILES
C1=CC=C(C=C1)C2(NC=CC(=O)N2)O
InChI
InChI=1S/C10H10N2O2/c13-9-6-7-11-10(14,12-9)8-4-2-1-3-5-8/h1-7,11,14H,(H,12,13)
InChIKey
MPFIRKHWYHEHGW-UHFFFAOYSA-N
Compound name
2-hydroxy-2-phenyl-1,3-dihydropyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.07423 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.08151 141.5
[M+Na]+ 213.06345 148.8
[M-H]- 189.06695 141.6
[M+NH4]+ 208.10805 157.9
[M+K]+ 229.03739 143.9
[M+H-H2O]+ 173.07149 134.4
[M+HCOO]- 235.07243 157.9
[M+CH3COO]- 249.08808 152.5
[M+Na-2H]- 211.04890 148.7
[M]+ 190.07368 134.7
[M]- 190.07478 134.7
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.