CID 9796315

9-[[(5r)-2-hydroxy-2-oxo-1,2$l^{5}-oxaphosphinan-5-yl]oxymethyl]purin-2-amine

Structural Information

Molecular Formula
C10H14N5O4P
SMILES
C1CP(=O)(OC[C@@H]1OCN2C=NC3=CN=C(N=C32)N)O
InChI
InChI=1S/C10H14N5O4P/c11-10-12-3-8-9(14-10)15(5-13-8)6-18-7-1-2-20(16,17)19-4-7/h3,5,7H,1-2,4,6H2,(H,16,17)(H2,11,12,14)/t7-/m1/s1
InChIKey
SPPYFDJJZSUQOS-SSDOTTSWSA-N
Compound name
9-[[(5R)-2-hydroxy-2-oxo-1,2lambda5-oxaphosphinan-5-yl]oxymethyl]purin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.07834 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.08562 162.6
[M+Na]+ 322.06756 171.1
[M-H]- 298.07106 163.2
[M+NH4]+ 317.11216 174.6
[M+K]+ 338.04150 169.5
[M+H-H2O]+ 282.07560 150.7
[M+HCOO]- 344.07654 184.2
[M+CH3COO]- 358.09219 199.5
[M+Na-2H]- 320.05301 165.5
[M]+ 299.07779 163.0
[M]- 299.07889 163.0
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.