CID 70907

(cyanoethyl)methyldiethoxysilane

Structural Information

Molecular Formula

C₈H₁₇NO₂Si

SMILES

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

InChI

InChI=1S/C8H17NO2Si/c1-4-10-12(3,11-5-2)8-6-7-9/h4-6,8H2,1-3H3

InChIKey

ITSZNKWGCBRYQB-UHFFFAOYSA-N

Compound name

3-[diethoxy(methyl)silyl]propanenitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 138
Patents: 187.10286 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]+	188.11014	138.9
[M+Na]+	210.09208	147.1
[M-H]-	186.09558	139.6
[M+NH4]+	205.13668	157.6
[M+K]+	226.06602	147.3
[M+H-H2O]+	170.10012	127.8
[M+HCOO]-	232.10106	157.5
[M+CH3COO]-	246.11671	194.2
[M+Na-2H]-	208.07753	145.0
[M]+	187.10231	138.5
[M]-	187.10341	138.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe