CID 56923

95521-11-2

Structural Information

Molecular Formula
C32H70N2O4Si2
SMILES
CCC[Si](C)(CCC)CCC[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)CCC[Si](C)(CCC)CCC
InChI
InChI=1S/C32H70N2O4Si2/c1-11-25-39(9,26-12-2)29-15-19-33(5,6)21-23-37-31(35)17-18-32(36)38-24-22-34(7,8)20-16-30-40(10,27-13-3)28-14-4/h11-30H2,1-10H3/q+2
InChIKey
TYHABRIVZQOODN-UHFFFAOYSA-N
Compound name
2-[4-[2-[dimethyl-[3-[methyl(dipropyl)silyl]propyl]azaniumyl]ethoxy]-4-oxobutanoyl]oxyethyl-dimethyl-[3-[methyl(dipropyl)silyl]propyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

602.4874 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 603.49468 270.2
[M+Na]+ 625.47662 273.6
[M+NH4]+ 620.52122 276.4
[M+K]+ 641.45056 277.3
[M-H]- 601.48012 264.7
[M+Na-2H]- 623.46207 258.9
[M]+ 602.48685 270.6
[M]- 602.48795 270.6
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.