CID 3087229

113611-75-9

Structural Information

Molecular Formula
C24H40N2O2Si
SMILES
CC[Si](CC)(CC)CCC[N+](C)(C)CCOC(=O)C1=[N+](C2=CC=CC=C2C=C1)C
InChI
InChI=1S/C24H40N2O2Si/c1-7-29(8-2,9-3)20-12-17-26(5,6)18-19-28-24(27)23-16-15-21-13-10-11-14-22(21)25(23)4/h10-11,13-16H,7-9,12,17-20H2,1-6H3/q+2
InChIKey
GRPXWNRORSFNLL-UHFFFAOYSA-N
Compound name
dimethyl-[2-(1-methylquinolin-1-ium-2-carbonyl)oxyethyl]-(3-triethylsilylpropyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

416.28592 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.29320 201.8
[M+Na]+ 439.27514 216.5
[M+NH4]+ 434.31974 210.2
[M+K]+ 455.24908 209.9
[M-H]- 415.27864 206.8
[M+Na-2H]- 437.26059 208.1
[M]+ 416.28537 206.2
[M]- 416.28647 206.2
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.