CID 6477467

Nsc668852

Structural Information

Molecular Formula
C20H35N3O5Si
SMILES
CC1=CN(C(=O)NC1=O)C2CC(C(O2)/C=[N+](\C(C)(C)C)/[O-])O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C20H35N3O5Si/c1-13-11-22(18(25)21-17(13)24)16-10-14(28-29(8,9)20(5,6)7)15(27-16)12-23(26)19(2,3)4/h11-12,14-16H,10H2,1-9H3,(H,21,24,25)/b23-12+
InChIKey
MZPUJMDPQYDNIB-FSJBWODESA-N
Compound name
N-tert-butyl-1-[3-[tert-butyl(dimethyl)silyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methanimine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

425.2346 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.24188 200.6
[M+Na]+ 448.22382 205.8
[M-H]- 424.22732 204.7
[M+NH4]+ 443.26842 208.6
[M+K]+ 464.19776 199.6
[M+H-H2O]+ 408.23186 198.8
[M+HCOO]- 470.23280 212.7
[M+CH3COO]- 484.24845 217.7
[M+Na-2H]- 446.20927 205.5
[M]+ 425.23405 201.3
[M]- 425.23515 201.3
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.