CID 87393

Triacetoxybutylsilane

Structural Information

Molecular Formula

C₁₀H₁₈O₆Si

SMILES

CCCC[Si](OC(=O)C)(OC(=O)C)OC(=O)C

InChI

InChI=1S/C10H18O6Si/c1-5-6-7-17(14-8(2)11,15-9(3)12)16-10(4)13/h5-7H2,1-4H3

InChIKey

LSDYFQXXPCPBQV-UHFFFAOYSA-N

Compound name

[diacetyloxy(butyl)silyl] acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 777
Patents: 262.08725 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	263.094526	155.3
[M+Na]+	285.076468	161.1
[M-H]-	261.079974	155.2
[M+NH4]+	280.121073	172.6
[M+K]+	301.050408	162.6
[M+H-H2O]+	245.084510	150.2
[M+HCOO]-	307.085451	175.1
[M+CH3COO]-	321.101101	192.6
[M+Na-2H]-	283.061916	157.3
[M]+	262.08670142	162.6
[M]-	262.08779858	162.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe