CID 6473871

(5z)-1-[(4s,5s)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]tetrahydrofuran-2-yl]-5-benzylidene-imidazolidine-2,4-dione

Structural Information

Molecular Formula
C31H33N5O4Si
SMILES
CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC[C@@H]3[C@H](CC(O3)N4/C(=C\C5=CC=CC=C5)/C(=O)NC4=O)N=[N+]=[N-]
InChI
InChI=1S/C31H33N5O4Si/c1-31(2,3)41(23-15-9-5-10-16-23,24-17-11-6-12-18-24)39-21-27-25(34-35-32)20-28(40-27)36-26(29(37)33-30(36)38)19-22-13-7-4-8-14-22/h4-19,25,27-28H,20-21H2,1-3H3,(H,33,37,38)/b26-19-/t25-,27+,28?/m0/s1
InChIKey
FMEMMHDFNKAHHP-ZCYHHINBSA-N
Compound name
(5Z)-1-[(4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]-5-benzylideneimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

567.23016 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 568.23744 235.8
[M+Na]+ 590.21938 235.6
[M-H]- 566.22288 249.8
[M+NH4]+ 585.26398 237.5
[M+K]+ 606.19332 225.7
[M+H-H2O]+ 550.22742 228.0
[M+HCOO]- 612.22836 252.6
[M+CH3COO]- 626.24401 248.8
[M+Na-2H]- 588.20483 238.0
[M]+ 567.22961 230.2
[M]- 567.23071 230.2
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.