CID 391265

Nsc690204

Structural Information

Molecular Formula
C10H15N3O3
SMILES
CC1(CCC(O1)N2C=CC(=NC2=O)N)CO
InChI
InChI=1S/C10H15N3O3/c1-10(6-14)4-2-8(16-10)13-5-3-7(11)12-9(13)15/h3,5,8,14H,2,4,6H2,1H3,(H2,11,12,15)
InChIKey
GWXVBPBERJHUKV-UHFFFAOYSA-N
Compound name
4-amino-1-[5-(hydroxymethyl)-5-methyloxolan-2-yl]pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

11
Patents

225.11134 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.11862 147.3
[M+Na]+ 248.10056 156.2
[M-H]- 224.10406 151.0
[M+NH4]+ 243.14516 164.3
[M+K]+ 264.07450 154.4
[M+H-H2O]+ 208.10860 140.3
[M+HCOO]- 270.10954 167.1
[M+CH3COO]- 284.12519 186.4
[M+Na-2H]- 246.08601 151.8
[M]+ 225.11079 146.2
[M]- 225.11189 146.2
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