CID 395086

Nsc699348

Structural Information

Molecular Formula
C24H45N3O7Si2
SMILES
CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@]2(CCN(CO2)O)C([C@@H](O1)N3C=CC(=O)NC3=O)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C24H45N3O7Si2/c1-22(2,3)35(7,8)32-15-17-24(12-14-26(30)16-31-24)19(34-36(9,10)23(4,5)6)20(33-17)27-13-11-18(28)25-21(27)29/h11,13,17,19-20,30H,12,14-16H2,1-10H3,(H,25,28,29)/t17-,19?,20-,24+/m1/s1
InChIKey
AXFJMFKSSXVHED-NMDPMABMSA-N
Compound name
1-[(1R,3R,5S)-4-[tert-butyl(dimethyl)silyl]oxy-1-[[tert-butyl(dimethyl)silyl]oxymethyl]-8-hydroxy-2,6-dioxa-8-azaspiro[4.5]decan-3-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

543.2796 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 544.28688 224.9
[M+Na]+ 566.26882 228.2
[M-H]- 542.27232 227.7
[M+NH4]+ 561.31342 227.6
[M+K]+ 582.24276 229.0
[M+H-H2O]+ 526.27686 218.5
[M+HCOO]- 588.27780 226.3
[M+CH3COO]- 602.29345 240.2
[M+Na-2H]- 564.25427 228.3
[M]+ 543.27905 227.8
[M]- 543.28015 227.8
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.