CID 5272206

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

Structural Information

Molecular Formula
C30H56N4O5Si3
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/C30H56N4O5Si3/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/h16-17,21-22,24-26H,19-20H2,1-15H3/t21?,22-,24-,25-,26-/m1/s1
InChIKey
ZMPLKBQCMOGOTF-QFAUVKNBSA-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-oxo-2,3-dihydroimidazo[1,2-c]pyrimidine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

636.35583 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 637.36311 250.2
[M+Na]+ 659.34505 252.9
[M-H]- 635.34855 251.8
[M+NH4]+ 654.38965 252.6
[M+K]+ 675.31899 252.8
[M+H-H2O]+ 619.35309 238.1
[M+HCOO]- 681.35403 248.4
[M+CH3COO]- 695.36968 266.9
[M+Na-2H]- 657.33050 249.9
[M]+ 636.35528 250.9
[M]- 636.35638 250.9
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.