CID 129939937

1-[2-(aminooxy)ethyl]-4-hydroxy-1,2-dihydropyrimidin-2-one hydrochloride

Structural Information

Molecular Formula
C6H9N3O3
SMILES
C1=CN(C(=O)NC1=O)CCON
InChI
InChI=1S/C6H9N3O3/c7-12-4-3-9-2-1-5(10)8-6(9)11/h1-2H,3-4,7H2,(H,8,10,11)
InChIKey
MCLHWRMOONDYQT-UHFFFAOYSA-N
Compound name
1-(2-aminooxyethyl)pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

171.06439 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.071666 131.6
[M+Na]+ 194.053608 141.3
[M-H]- 170.057114 131.4
[M+NH4]+ 189.098213 148.3
[M+K]+ 210.027548 138.7
[M+H-H2O]+ 154.061650 124.5
[M+HCOO]- 216.062591 154.4
[M+CH3COO]- 230.078241 176.3
[M+Na-2H]- 192.039056 138.7
[M]+ 171.06384142 131.4
[M]- 171.06493858 131.4
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