CID 131668139

119433-08-8

Structural Information

Molecular Formula
C20H40O3Si
SMILES
CCOC(=O)[C@@H](C)C/C(=C/[C@H](C)C[C@H](C)O[Si](C)(C)C(C)(C)C)/C
InChI
InChI=1S/C20H40O3Si/c1-11-22-19(21)17(4)13-15(2)12-16(3)14-18(5)23-24(9,10)20(6,7)8/h12,16-18H,11,13-14H2,1-10H3/b15-12+/t16-,17-,18-/m0/s1
InChIKey
NFBRSOAOWIRVBV-VVSHCGRSSA-N
Compound name
ethyl (E,2S,6R,8S)-8-[tert-butyl(dimethyl)silyl]oxy-2,4,6-trimethylnon-4-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.27466 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.28194 190.2
[M+Na]+ 379.26388 192.0
[M-H]- 355.26738 189.0
[M+NH4]+ 374.30848 202.5
[M+K]+ 395.23782 191.7
[M+H-H2O]+ 339.27192 185.2
[M+HCOO]- 401.27286 199.8
[M+CH3COO]- 415.28851 219.2
[M+Na-2H]- 377.24933 185.7
[M]+ 356.27411 195.9
[M]- 356.27521 195.9
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.