CID 21579531

185899-45-0

Structural Information

Molecular Formula
C20H35NO7Si
SMILES
CC(=O)O[C@H]1CN2CC[C@@H]([C@@H]2[C@H]([C@@H]1OC(=O)C)OC(=O)C)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C20H35NO7Si/c1-12(22)25-16-11-21-10-9-15(28-29(7,8)20(4,5)6)17(21)19(27-14(3)24)18(16)26-13(2)23/h15-19H,9-11H2,1-8H3/t15-,16-,17+,18+,19+/m0/s1
InChIKey
QCTLSHPYNMVGII-NTZUZEMLSA-N
Compound name
[(1S,6S,7R,8R,8aS)-7,8-diacetyloxy-1-[tert-butyl(dimethyl)silyl]oxy-1,2,3,5,6,7,8,8a-octahydroindolizin-6-yl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.2183 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.22558 195.2
[M+Na]+ 452.20752 199.1
[M+NH4]+ 447.25212 197.6
[M+K]+ 468.18146 200.9
[M-H]- 428.21102 190.7
[M+Na-2H]- 450.19297 191.7
[M]+ 429.21775 193.9
[M]- 429.21885 193.9
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.