CID 14024

3-cyanopropyltriethoxysilane

Structural Information

Molecular Formula

C₁₀H₂₁NO₃Si

SMILES

CCO[Si](CCCC#N)(OCC)OCC

InChI

InChI=1S/C10H21NO3Si/c1-4-12-15(13-5-2,14-6-3)10-8-7-9-11/h4-8,10H2,1-3H3

InChIKey

VGIURMCNTDVGJM-UHFFFAOYSA-N

Compound name

4-triethoxysilylbutanenitrile

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 4
References: 2343
Patents: 231.12907 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]+	232.13635	148.8
[M+Na]+	254.11829	156.2
[M-H]-	230.12179	149.1
[M+NH4]+	249.16289	165.9
[M+K]+	270.09223	156.4
[M+H-H2O]+	214.12633	137.1
[M+HCOO]-	276.12727	167.1
[M+CH3COO]-	290.14292	201.3
[M+Na-2H]-	252.10374	154.1
[M]+	231.12852	150.4
[M]-	231.12962	150.4

Literature stripe

literature stripe

Patent stripe

patents stripe