CID 3086286

1-(2-deoxy-alpha-d-ribofuranosyl)-5-trimethylsilyluracil hydrate

Structural Information

Molecular Formula
C12H20N2O5Si
SMILES
C[Si](C)(C)C1=CN(C(=O)NC1=O)[C@@H]2C[C@@H]([C@H](O2)CO)O
InChI
InChI=1S/C12H20N2O5Si/c1-20(2,3)9-5-14(12(18)13-11(9)17)10-4-7(16)8(6-15)19-10/h5,7-8,10,15-16H,4,6H2,1-3H3,(H,13,17,18)/t7-,8+,10-/m0/s1
InChIKey
DZEOQTVJWBLBOT-XKSSXDPKSA-N
Compound name
1-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-trimethylsilylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.11414 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.12142 165.5
[M+Na]+ 323.10336 175.1
[M+NH4]+ 318.14796 169.2
[M+K]+ 339.07730 174.9
[M-H]- 299.10686 165.0
[M+Na-2H]- 321.08881 166.6
[M]+ 300.11359 166.3
[M]- 300.11469 166.3
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.