CID 14529803

1-(3-hydroxyphenyl)dihydropyrimidine-2,4(1h,3h)-dione

Structural Information

Molecular Formula
C10H10N2O3
SMILES
C1CN(C(=O)NC1=O)C2=CC(=CC=C2)O
InChI
InChI=1S/C10H10N2O3/c13-8-3-1-2-7(6-8)12-5-4-9(14)11-10(12)15/h1-3,6,13H,4-5H2,(H,11,14,15)
InChIKey
NUEWZBOGLYTCGZ-UHFFFAOYSA-N
Compound name
1-(3-hydroxyphenyl)-1,3-diazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

206.06914 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 144.0
[M+Na]+ 229.05836 151.6
[M-H]- 205.06186 145.3
[M+NH4]+ 224.10296 158.7
[M+K]+ 245.03230 147.6
[M+H-H2O]+ 189.06640 136.3
[M+HCOO]- 251.06734 160.7
[M+CH3COO]- 265.08299 179.5
[M+Na-2H]- 227.04381 148.1
[M]+ 206.06859 138.7
[M]- 206.06969 138.7
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

patents stripe