CID 87474

Butylmethyldichlorosilane

Structural Information

Molecular Formula

C₅H₁₂Cl₂Si

SMILES

CCCC[Si](C)(Cl)Cl

InChI

InChI=1S/C5H12Cl2Si/c1-3-4-5-8(2,6)7/h3-5H2,1-2H3

InChIKey

UACGRVDRVCFSEA-UHFFFAOYSA-N

Compound name

butyl-dichloro-methylsilane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 440
Patents: 170.00853 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]+	171.015806	132.2
[M+Na]+	192.997748	141.0
[M-H]-	169.001254	132.0
[M+NH4]+	188.042353	154.8
[M+K]+	208.971688	137.2
[M+H-H2O]+	153.005790	130.0
[M+HCOO]-	215.006731	144.7
[M+CH3COO]-	229.022381	176.8
[M+Na-2H]-	190.983196	138.5
[M]+	170.00798142	135.4
[M]-	170.00907858	135.4

Literature stripe

literature stripe

Patent stripe

patents stripe