CID 3048054

63884-28-6

Structural Information

Molecular Formula
C22H46N2
SMILES
C[N+]1(CCCCC1)CCCCCCCCCC[N+]2(CCCCC2)C
InChI
InChI=1S/C22H46N2/c1-23(19-13-9-14-20-23)17-11-7-5-3-4-6-8-12-18-24(2)21-15-10-16-22-24/h3-22H2,1-2H3/q+2
InChIKey
FVRLPRFLAPVBSW-UHFFFAOYSA-N
Compound name
1-methyl-1-[10-(1-methylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

338.3661 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.37338 192.3
[M+Na]+ 361.35532 205.1
[M+NH4]+ 356.39992 205.0
[M+K]+ 377.32926 192.5
[M-H]- 337.35882 198.9
[M+Na-2H]- 359.34077 200.5
[M]+ 338.36555 197.0
[M]- 338.36665 197.0
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