CID 15958321

2-[3-[(2r,3r,4r,5r)-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-2,6-dioxo-pyrimidin-1-yl]acetonitrile

Structural Information

Molecular Formula
C24H43N3O6Si2
SMILES
CC1=CN(C(=O)N(C1=O)CC#N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[Si](C)(C)C(C)(C)C)O)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C24H43N3O6Si2/c1-16-14-27(22(30)26(13-12-25)20(16)29)21-19(33-35(10,11)24(5,6)7)18(28)17(32-21)15-31-34(8,9)23(2,3)4/h14,17-19,21,28H,13,15H2,1-11H3/t17-,18-,19-,21-/m1/s1
InChIKey
GPSXLVXRTRXCAL-ANTGDGSKSA-N
Compound name
2-[3-[(2R,3R,4R,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

525.26904 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 526.27632 221.9
[M+Na]+ 548.25826 228.5
[M-H]- 524.26176 224.2
[M+NH4]+ 543.30286 226.3
[M+K]+ 564.23220 228.3
[M+H-H2O]+ 508.26630 208.8
[M+HCOO]- 570.26724 227.4
[M+CH3COO]- 584.28289 249.0
[M+Na-2H]- 546.24371 221.2
[M]+ 525.26849 223.7
[M]- 525.26959 223.7
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

No patent data available for this compound.