CID 6476962

Nsc699327

Structural Information

Molecular Formula
C23H42N2O6Si2
SMILES
CC(C)(C)[Si](C)(C)OC[C@@H]1/C(=C\CO)/[C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C23H42N2O6Si2/c1-22(2,3)32(7,8)29-15-17-16(12-14-26)19(31-33(9,10)23(4,5)6)20(30-17)25-13-11-18(27)24-21(25)28/h11-13,17,19-20,26H,14-15H2,1-10H3,(H,24,27,28)/b16-12+/t17-,19-,20-/m1/s1
InChIKey
FINSZMOWMGNTBF-NIPDGEDPSA-N
Compound name
1-[(2R,3R,4E,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(2-hydroxyethylidene)oxolan-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

498.25815 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 499.26543 217.3
[M+Na]+ 521.24737 221.7
[M-H]- 497.25087 219.1
[M+NH4]+ 516.29197 222.8
[M+K]+ 537.22131 220.0
[M+H-H2O]+ 481.25541 211.1
[M+HCOO]- 543.25635 224.3
[M+CH3COO]- 557.27200 233.0
[M+Na-2H]- 519.23282 218.3
[M]+ 498.25760 222.1
[M]- 498.25870 222.1
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.