CID 87426

Phenyltriacetoxysilane

Structural Information

Molecular Formula

C₁₂H₁₄O₆Si

SMILES

CC(=O)O[Si](C1=CC=CC=C1)(OC(=O)C)OC(=O)C

InChI

InChI=1S/C12H14O6Si/c1-9(13)16-19(17-10(2)14,18-11(3)15)12-7-5-4-6-8-12/h4-8H,1-3H3

InChIKey

VLFKGWCMFMCFRM-UHFFFAOYSA-N

Compound name

[diacetyloxy(phenyl)silyl] acetate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 4538
Patents: 282.05597 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]+	283.06325	157.8
[M+Na]+	305.04519	163.8
[M-H]-	281.04869	161.2
[M+NH4]+	300.08979	173.8
[M+K]+	321.01913	164.5
[M+H-H2O]+	265.05323	151.5
[M+HCOO]-	327.05417	178.4
[M+CH3COO]-	341.06982	194.1
[M+Na-2H]-	303.03064	161.4
[M]+	282.05542	163.2
[M]-	282.05652	163.2

Literature stripe

literature stripe

Patent stripe

patents stripe