CID 87619

3-trimethylsilylpropyl acetate

Structural Information

Molecular Formula
C8H18O2Si
SMILES
CC(=O)OCCC[Si](C)(C)C
InChI
InChI=1S/C8H18O2Si/c1-8(9)10-6-5-7-11(2,3)4/h5-7H2,1-4H3
InChIKey
XVHIVCBIAKEVLK-UHFFFAOYSA-N
Compound name
3-trimethylsilylpropyl acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

174.1076 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.11488 138.6
[M+Na]+ 197.09682 148.0
[M+NH4]+ 192.14142 145.8
[M+K]+ 213.07076 143.3
[M-H]- 173.10032 137.0
[M+Na-2H]- 195.08227 141.4
[M]+ 174.10705 139.3
[M]- 174.10815 139.3
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