CID 14569053

4-aminopyrimidin-5-ol

Structural Information

Molecular Formula
C4H5N3O
SMILES
C1=C(C(=NC=N1)N)O
InChI
InChI=1S/C4H5N3O/c5-4-3(8)1-6-2-7-4/h1-2,8H,(H2,5,6,7)
InChIKey
QPISWILGPJGWLV-UHFFFAOYSA-N
Compound name
4-aminopyrimidin-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

111.04326 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.05054 117.8
[M+Na]+ 134.03248 130.1
[M+NH4]+ 129.07708 125.6
[M+K]+ 150.00642 125.4
[M-H]- 110.03598 118.7
[M+Na-2H]- 132.01793 124.9
[M]+ 111.04271 119.6
[M]- 111.04381 119.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe