CID 13522

919-31-3

Structural Information

Molecular Formula

C₉H₁₉NO₃Si

SMILES

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

InChI

InChI=1S/C9H19NO3Si/c1-4-11-14(12-5-2,13-6-3)9-7-8-10/h4-7,9H2,1-3H3

InChIKey

GBQYMXVQHATSCC-UHFFFAOYSA-N

Compound name

3-triethoxysilylpropanenitrile

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 7
References: 3827
Patents: 217.11342 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]+	218.12070	145.6
[M+Na]+	240.10264	154.1
[M+NH4]+	235.14724	148.7
[M+K]+	256.07658	146.4
[M-H]-	216.10614	136.8
[M+Na-2H]-	238.08809	146.0
[M]+	217.11287	143.3
[M]-	217.11397	143.3

Literature stripe

literature stripe

Patent stripe

patents stripe