CID 62254

Disiquonium chloride

Structural Information

Molecular Formula
C27H60NO3Si
SMILES
CCCCCCCCCC[N+](C)(CCCCCCCCCC)CCC[Si](OC)(OC)OC
InChI
InChI=1S/C27H60NO3Si/c1-7-9-11-13-15-17-19-21-24-28(3,25-22-20-18-16-14-12-10-8-2)26-23-27-32(29-4,30-5)31-6/h7-27H2,1-6H3/q+1
InChIKey
CZIAHOKVOQSYHN-UHFFFAOYSA-N
Compound name
didecyl-methyl-(3-trimethoxysilylpropyl)azanium
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

591
Patents

474.43423 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 475.44151 240.9
[M+Na]+ 497.42345 244.4
[M+NH4]+ 492.46805 246.5
[M+K]+ 513.39739 248.4
[M-H]- 473.42695 233.6
[M+Na-2H]- 495.40890 231.1
[M]+ 474.43368 240.4
[M]- 474.43478 240.4
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

patents stripe