CID 55438

Brn 5611586

Structural Information

Molecular Formula
C21H36O4Si
SMILES
CCCC[Si](CC)(CCCC)OC(C1=CC=CC=C1OC)C(=O)OCC
InChI
InChI=1S/C21H36O4Si/c1-6-10-16-26(9-4,17-11-7-2)25-20(21(22)24-8-3)18-14-12-13-15-19(18)23-5/h12-15,20H,6-11,16-17H2,1-5H3
InChIKey
CLBJLFKHTUCHBO-UHFFFAOYSA-N
Compound name
ethyl 2-[dibutyl(ethyl)silyl]oxy-2-(2-methoxyphenyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.23828 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.24556 196.9
[M+Na]+ 403.22750 199.6
[M-H]- 379.23100 198.7
[M+NH4]+ 398.27210 209.4
[M+K]+ 419.20144 197.6
[M+H-H2O]+ 363.23554 189.0
[M+HCOO]- 425.23648 214.5
[M+CH3COO]- 439.25213 220.0
[M+Na-2H]- 401.21295 195.8
[M]+ 380.23773 205.2
[M]- 380.23883 205.2
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.