CID 496902

Nsc706089

Structural Information

Molecular Formula
C25H44N2O8Si2
SMILES
CC1=CN(C(=O)NC1=O)C2C(C3(C(O2)CO[Si](C)(C)C(C)(C)C)C(O3)C(=O)OC)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C25H44N2O8Si2/c1-15-13-27(22(30)26-19(15)28)20-17(35-37(11,12)24(5,6)7)25(18(34-25)21(29)31-8)16(33-20)14-32-36(9,10)23(2,3)4/h13,16-18,20H,14H2,1-12H3,(H,26,28,30)
InChIKey
CEHRWWGFCKISDJ-UHFFFAOYSA-N
Compound name
methyl 4-[tert-butyl(dimethyl)silyl]oxy-7-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-1,6-dioxaspiro[2.4]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

556.2636 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 557.27088 224.4
[M+Na]+ 579.25282 231.4
[M-H]- 555.25632 231.2
[M+NH4]+ 574.29742 225.2
[M+K]+ 595.22676 231.8
[M+H-H2O]+ 539.26086 220.6
[M+HCOO]- 601.26180 230.3
[M+CH3COO]- 615.27745 246.8
[M+Na-2H]- 577.23827 227.6
[M]+ 556.26305 237.5
[M]- 556.26415 237.5
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.