CID 9885624

161055-41-0

Structural Information

Molecular Formula
C20H40O2Si2
SMILES
CC(C)(C)[Si](C)(C)O[C@H](CC#C)C[C@@H](C=C)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C20H40O2Si2/c1-13-15-18(22-24(11,12)20(6,7)8)16-17(14-2)21-23(9,10)19(3,4)5/h1,14,17-18H,2,15-16H2,3-12H3/t17-,18-/m1/s1
InChIKey
YWXRFHFTKNUFLE-QZTJIDSGSA-N
Compound name
tert-butyl-[(3S,5R)-5-[tert-butyl(dimethyl)silyl]oxyoct-1-en-7-yn-3-yl]oxy-dimethylsilane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

368.25668 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.26396 192.7
[M+Na]+ 391.24590 197.4
[M-H]- 367.24940 191.5
[M+NH4]+ 386.29050 205.3
[M+K]+ 407.21984 195.9
[M+H-H2O]+ 351.25394 182.4
[M+HCOO]- 413.25488 199.6
[M+CH3COO]- 427.27053 223.1
[M+Na-2H]- 389.23135 192.3
[M]+ 368.25613 192.3
[M]- 368.25723 192.3
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