CID 6477986

Nsc667854

Structural Information

Molecular Formula
C23H33N3O5Si
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@H]([C@H](O2)CO[Si](C)(C)C(C)(C)C)/[N+](=C/C3=CC=CC=C3)/[O-]
InChI
InChI=1S/C23H33N3O5Si/c1-16-13-25(22(28)24-21(16)27)20-12-18(26(29)14-17-10-8-7-9-11-17)19(31-20)15-30-32(5,6)23(2,3)4/h7-11,13-14,18-20H,12,15H2,1-6H3,(H,24,27,28)/b26-14-/t18-,19-,20-/m1/s1
InChIKey
LNZKRUQYMWYIEV-LMDMGSFJSA-N
Compound name
N-[(2S,3R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]-1-phenylmethanimine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

459.21893 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 460.22621 210.8
[M+Na]+ 482.20815 214.9
[M-H]- 458.21165 217.5
[M+NH4]+ 477.25275 216.3
[M+K]+ 498.18209 207.0
[M+H-H2O]+ 442.21619 206.2
[M+HCOO]- 504.21713 224.4
[M+CH3COO]- 518.23278 223.0
[M+Na-2H]- 480.19360 213.9
[M]+ 459.21838 210.3
[M]- 459.21948 210.3
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.