CID 82183

7733-78-0

Structural Information

Molecular Formula

C₆H₁₄O₃Si

SMILES

C[Si]1(OCCOCCO1)C

InChI

InChI=1S/C6H14O3Si/c1-10(2)8-5-3-7-4-6-9-10/h3-6H2,1-2H3

InChIKey

WNTQZCOSFQWNDG-UHFFFAOYSA-N

Compound name

2,2-dimethyl-1,3,6,2-trioxasilocane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 162.07123 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]+	163.07851	145.7
[M+Na]+	185.06045	150.2
[M-H]-	161.06395	148.3
[M+NH4]+	180.10505	154.4
[M+K]+	201.03439	152.9
[M+H-H2O]+	145.06849	142.7
[M+HCOO]-	207.06943	153.9
[M+CH3COO]-	221.08508	217.6
[M+Na-2H]-	183.04590	148.2
[M]+	162.07068	145.7
[M]-	162.07178	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe