CID 89844

Einecs 245-233-0

Structural Information

Molecular Formula
C20H51N3O7Si4
SMILES
CCCC[Si]1(O[Si](O[Si](O[Si](O1)(C)ON(CC)CC)(C)ON(CC)CC)(C)ON(CC)CC)C
InChI
InChI=1S/C20H51N3O7Si4/c1-12-19-20-31(8)27-32(9,24-21(13-2)14-3)29-34(11,26-23(17-6)18-7)30-33(10,28-31)25-22(15-4)16-5/h12-20H2,1-11H3
InChIKey
JTFGXWXAESOYDL-UHFFFAOYSA-N
Compound name
N-[[4-butyl-6,8-bis(diethylaminooxy)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

557.2804 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 558.28768 215.3
[M+Na]+ 580.26962 217.6
[M-H]- 556.27312 218.6
[M+NH4]+ 575.31422 219.9
[M+K]+ 596.24356 221.8
[M+H-H2O]+ 540.27766 211.2
[M+HCOO]- 602.27860 221.4
[M+CH3COO]- 616.29425 254.9
[M+Na-2H]- 578.25507 212.3
[M]+ 557.27985 221.4
[M]- 557.28095 221.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.