CID 99527

1,1-dimethylethyl trimethylsilylacetate

Structural Information

Molecular Formula
C9H20O2Si
SMILES
CC(C)(C)OC(=O)C[Si](C)(C)C
InChI
InChI=1S/C9H20O2Si/c1-9(2,3)11-8(10)7-12(4,5)6/h7H2,1-6H3
InChIKey
HOHBQWITMXOSOW-UHFFFAOYSA-N
Compound name
tert-butyl 2-trimethylsilylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

188.12326 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.13054 142.1
[M+Na]+ 211.11248 148.9
[M-H]- 187.11598 142.6
[M+NH4]+ 206.15708 163.1
[M+K]+ 227.08642 149.4
[M+H-H2O]+ 171.12052 138.5
[M+HCOO]- 233.12146 161.3
[M+CH3COO]- 247.13711 182.7
[M+Na-2H]- 209.09793 147.5
[M]+ 188.12271 145.5
[M]- 188.12381 145.5
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