CID 453158

132198-21-1

Structural Information

Molecular Formula
C10H15N3O3
SMILES
C1C[C@H](O[C@H](C1)N2C=CC(=NC2=O)N)CO
InChI
InChI=1S/C10H15N3O3/c11-8-4-5-13(10(15)12-8)9-3-1-2-7(6-14)16-9/h4-5,7,9,14H,1-3,6H2,(H2,11,12,15)/t7-,9+/m0/s1
InChIKey
HJAFVRYMUIMPCH-IONNQARKSA-N
Compound name
4-amino-1-[(2R,6S)-6-(hydroxymethyl)oxan-2-yl]pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.11134 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.11862 150.3
[M+Na]+ 248.10056 157.4
[M-H]- 224.10406 153.2
[M+NH4]+ 243.14516 163.2
[M+K]+ 264.07450 155.2
[M+H-H2O]+ 208.10860 141.7
[M+HCOO]- 270.10954 167.8
[M+CH3COO]- 284.12519 187.4
[M+Na-2H]- 246.08601 154.9
[M]+ 225.11079 146.6
[M]- 225.11189 146.6
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.