CID 16744148

688359-84-4

Structural Information

Molecular Formula
C7H12BrCl3O2Si
SMILES
CC(C)(C(=O)OCCC[Si](Cl)(Cl)Cl)Br
InChI
InChI=1S/C7H12BrCl3O2Si/c1-7(2,8)6(12)13-4-3-5-14(9,10)11/h3-5H2,1-2H3
InChIKey
GEVOCWHKMYIZGM-UHFFFAOYSA-N
Compound name
3-trichlorosilylpropyl 2-bromo-2-methylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

339.88556 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.89284 159.0
[M+Na]+ 362.87478 171.4
[M-H]- 338.87828 161.0
[M+NH4]+ 357.91938 178.5
[M+K]+ 378.84872 157.3
[M+H-H2O]+ 322.88282 162.1
[M+HCOO]- 384.88376 162.4
[M+CH3COO]- 398.89941 200.3
[M+Na-2H]- 360.86023 164.3
[M]+ 339.88501 181.1
[M]- 339.88611 181.1
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