CID 9578745

Nsc701708

Structural Information

Molecular Formula
C23H43N3O7Si2
SMILES
CC(C)(C)[Si](C)(C)OC[C@H]1C([C@@H]([C@H](O1)N2C=CC(=O)NC2=O)O[Si](C)(C)C(C)(C)C)(C/C=N/O)O
InChI
InChI=1S/C23H43N3O7Si2/c1-21(2,3)34(7,8)31-15-16-23(29,12-13-24-30)18(33-35(9,10)22(4,5)6)19(32-16)26-14-11-17(27)25-20(26)28/h11,13-14,16,18-19,29-30H,12,15H2,1-10H3,(H,25,27,28)/b24-13+/t16-,18+,19-,23?/m0/s1
InChIKey
HEWKPBHTSGGJAG-ZNLXMKGASA-N
Compound name
1-[(2S,3S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxy-4-[(2E)-2-hydroxyiminoethyl]oxolan-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

529.264 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 530.27128 220.3
[M+Na]+ 552.25322 224.2
[M-H]- 528.25672 222.2
[M+NH4]+ 547.29782 226.0
[M+K]+ 568.22716 224.1
[M+H-H2O]+ 512.26126 214.9
[M+HCOO]- 574.26220 228.5
[M+CH3COO]- 588.27785 240.1
[M+Na-2H]- 550.23867 224.7
[M]+ 529.26345 226.2
[M]- 529.26455 226.2
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.