CID 3048286

As-10,794

Structural Information

Molecular Formula
C15H34N2O
SMILES
CC[N+]1(CCCCC1)CCOCC[N+](C)(C)CC
InChI
InChI=1S/C15H34N2O/c1-5-16(3,4)12-14-18-15-13-17(6-2)10-8-7-9-11-17/h5-15H2,1-4H3/q+2
InChIKey
ZYHFYZAZLVNGTQ-UHFFFAOYSA-N
Compound name
ethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.26712 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.27440 162.7
[M+Na]+ 281.25634 165.2
[M-H]- 257.25984 165.0
[M+NH4]+ 276.30094 180.3
[M+K]+ 297.23028 153.4
[M+H-H2O]+ 241.26438 161.6
[M+HCOO]- 303.26532 179.8
[M+CH3COO]- 317.28097 190.6
[M+Na-2H]- 279.24179 172.3
[M]+ 258.26657 160.0
[M]- 258.26767 160.0
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

No patent data available for this compound.