CID 10792263

Nsc693092

Structural Information

Molecular Formula
C23H41N3O7Si2
SMILES
CC(C)(C)[Si](C)(C)OC[C@@H]1[C@]2([C@H]([C@@H](O1)N3C=CC(=O)NC3=O)O[Si](C)(C)C(C)(C)C)[C@@H](O2)C(=O)N
InChI
InChI=1S/C23H41N3O7Si2/c1-21(2,3)34(7,8)30-13-14-23(16(32-23)18(24)28)17(33-35(9,10)22(4,5)6)19(31-14)26-12-11-15(27)25-20(26)29/h11-12,14,16-17,19H,13H2,1-10H3,(H2,24,28)(H,25,27,29)/t14-,16+,17+,19-,23-/m1/s1
InChIKey
ORAHAOMNMKUNSC-IDMCENKTSA-N
Compound name
(2R,3R,4R,5R,7R)-4-[tert-butyl(dimethyl)silyl]oxy-7-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-1,6-dioxaspiro[2.4]heptane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

527.2483 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 528.25558 218.1
[M+Na]+ 550.23752 224.5
[M-H]- 526.24102 224.3
[M+NH4]+ 545.28212 219.2
[M+K]+ 566.21146 224.2
[M+H-H2O]+ 510.24556 214.1
[M+HCOO]- 572.24650 224.9
[M+CH3COO]- 586.26215 243.3
[M+Na-2H]- 548.22297 222.0
[M]+ 527.24775 227.2
[M]- 527.24885 227.2
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.