CID 102857

(1-cyanoethyl)trichlorosilane

Structural Information

Molecular Formula

C₃H₄Cl₃NSi

SMILES

CC(C#N)[Si](Cl)(Cl)Cl

InChI

InChI=1S/C3H4Cl3NSi/c1-3(2-7)8(4,5)6/h3H,1H3

InChIKey

JHVCHXGNRUSRFD-UHFFFAOYSA-N

Compound name

2-trichlorosilylpropanenitrile

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 54
Patents: 186.91786 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]+	187.925136	133.8
[M+Na]+	209.907078	145.0
[M-H]-	185.910584	133.7
[M+NH4]+	204.951683	153.3
[M+K]+	225.881018	140.5
[M+H-H2O]+	169.915120	126.1
[M+HCOO]-	231.916061	139.1
[M+CH3COO]-	245.931711	190.8
[M+Na-2H]-	207.892526	138.5
[M]+	186.91731142	130.7
[M]-	186.91840858	130.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe