CID 5272209

6-(2,3,5-tri-o-tert-butyldimethylsilyl-.beta.-d-ribofuranosyl)-5-oxo-5,6-dihydro-imidazo[1,2-c]pyrimidine-2-carbonitrile

Structural Information

Molecular Formula
C30H54N4O5Si3
SMILES
CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC3=NC(=CN3C2=O)C#N)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C30H54N4O5Si3/c1-28(2,3)40(10,11)36-20-22-24(38-41(12,13)29(4,5)6)25(39-42(14,15)30(7,8)9)26(37-22)33-17-16-23-32-21(18-31)19-34(23)27(33)35/h16-17,19,22,24-26H,20H2,1-15H3/t22-,24-,25-,26-/m1/s1
InChIKey
PIZWDQCXGCTXPW-VNSJUHMKSA-N
Compound name
6-[(2R,3R,4R,5R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-5-oxoimidazo[1,2-c]pyrimidine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

634.3402 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 635.34748 254.0
[M+Na]+ 657.32942 258.8
[M-H]- 633.33292 256.5
[M+NH4]+ 652.37402 256.5
[M+K]+ 673.30336 258.5
[M+H-H2O]+ 617.33746 241.0
[M+HCOO]- 679.33840 255.5
[M+CH3COO]- 693.35405 265.9
[M+Na-2H]- 655.31487 254.9
[M]+ 634.33965 257.8
[M]- 634.34075 257.8
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.