CID 519486

Pentacyclo[9.5.1.13,9.15,15.17,13]octasiloxane, 1,3,5,7,9,11,13,15-octamethyl-

Structural Information

Molecular Formula
C8H24O12Si8
SMILES
C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)C)C)C)C)C)C)C
InChI
InChI=1S/C8H24O12Si8/c1-21-9-22(2)12-25(5)14-23(3,10-21)16-27(7)17-24(4,11-21)15-26(6,13-22)19-28(8,18-25)20-27/h1-8H3
InChIKey
SOQGBGSEJYZNPS-UHFFFAOYSA-N
Compound name
1,3,5,7,9,11,13,15-octamethyl-2,4,6,8,10,12,14,16,17,18,19,20-dodecaoxa-1,3,5,7,9,11,13,15-octasilapentacyclo[9.5.1.13,9.15,15.17,13]icosane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

476
Patents

535.9422 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 536.94948 112.8
[M+Na]+ 558.93142 112.8
[M-H]- 534.93492 112.8
[M+NH4]+ 553.97602 112.8
[M+K]+ 574.90536 112.8
[M+H-H2O]+ 518.93946 112.8
[M+HCOO]- 580.94040 112.8
[M+CH3COO]- 594.95605 112.8
[M+Na-2H]- 556.91687 311.5
[M]+ 535.94165 112.8
[M]- 535.94275 112.8
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

patents stripe