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
2
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]+ 191.081506 141.5
[M+Na]+ 213.063448 148.8
[M-H]- 189.066954 141.6
[M+NH4]+ 208.108053 157.9
[M+K]+ 229.037388 143.9
[M+H-H2O]+ 173.071490 134.4
[M+HCOO]- 235.072431 157.9
[M+CH3COO]- 249.088081 152.5
[M+Na-2H]- 211.048896 148.7
[M]+ 190.07368142 134.7
[M]- 190.07477858 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.