CID 9823928

139356-36-8

Structural Information

Molecular Formula
C22H44O4Si2
SMILES
CCOC(=O)C=C1C[C@H](C[C@@H](C1)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C22H44O4Si2/c1-12-24-20(23)15-17-13-18(25-27(8,9)21(2,3)4)16-19(14-17)26-28(10,11)22(5,6)7/h15,18-19H,12-14,16H2,1-11H3/t18-,19-/m1/s1
InChIKey
VKHVAGVBCANCSM-RTBURBONSA-N
Compound name
ethyl 2-[(3R,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]cyclohexylidene]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

428.2778 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.28508 200.9
[M+Na]+ 451.26702 202.8
[M-H]- 427.27052 202.6
[M+NH4]+ 446.31162 212.9
[M+K]+ 467.24096 202.1
[M+H-H2O]+ 411.27506 195.9
[M+HCOO]- 473.27600 210.2
[M+CH3COO]- 487.29165 226.5
[M+Na-2H]- 449.25247 201.5
[M]+ 428.27725 204.6
[M]- 428.27835 204.6
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

patents stripe