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 198.4
[M+Na]+ 452.20752 201.5
[M-H]- 428.21102 200.1
[M+NH4]+ 447.25212 210.6
[M+K]+ 468.18146 202.4
[M+H-H2O]+ 412.21556 193.5
[M+HCOO]- 474.21650 208.1
[M+CH3COO]- 488.23215 226.8
[M+Na-2H]- 450.19297 195.4
[M]+ 429.21775 203.5
[M]- 429.21885 203.5
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.