CID 3087225

2-((2-(dimethyl(3-(trimethylsilyl)propyl)ammonio)ethoxy)carbonyl)-1-methylquinolinium diiodide

Structural Information

Molecular Formula
C21H34N2O2Si
SMILES
C[N+]1=C(C=CC2=CC=CC=C21)C(=O)OCC[N+](C)(C)CCC[Si](C)(C)C
InChI
InChI=1S/C21H34N2O2Si/c1-22-19-11-8-7-10-18(19)12-13-20(22)21(24)25-16-15-23(2,3)14-9-17-26(4,5)6/h7-8,10-13H,9,14-17H2,1-6H3/q+2
InChIKey
QQOJUKGWORKASI-UHFFFAOYSA-N
Compound name
dimethyl-[2-(1-methylquinolin-1-ium-2-carbonyl)oxyethyl]-(3-trimethylsilylpropyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.23895 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.24623 188.3
[M+Na]+ 397.22817 203.6
[M+NH4]+ 392.27277 197.2
[M+K]+ 413.20211 197.8
[M-H]- 373.23167 193.5
[M+Na-2H]- 395.21362 195.4
[M]+ 374.23840 192.9
[M]- 374.23950 192.9
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.