CID 112903

(3-phthalimidopropyl)trichlorosilane

Structural Information

Molecular Formula

C₁₁H₁₀Cl₃NO₂Si

SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC[Si](Cl)(Cl)Cl

InChI

InChI=1S/C11H10Cl3NO2Si/c12-18(13,14)7-3-6-15-10(16)8-4-1-2-5-9(8)11(15)17/h1-2,4-5H,3,6-7H2

InChIKey

JPPVZXBHRRERQZ-UHFFFAOYSA-N

Compound name

2-(3-trichlorosilylpropyl)isoindole-1,3-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 320.95465 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]+	321.96193	168.1
[M+Na]+	343.94387	179.0
[M-H]-	319.94737	169.6
[M+NH4]+	338.98847	186.1
[M+K]+	359.91781	172.1
[M+H-H2O]+	303.95191	163.5
[M+HCOO]-	365.95285	173.2
[M+CH3COO]-	379.96850	200.4
[M+Na-2H]-	341.92932	170.2
[M]+	320.95410	172.4
[M]-	320.95520	172.4

Literature stripe

literature stripe

Patent stripe

patents stripe