CID 211630

23489-02-3

Structural Information

Molecular Formula
C16H34N
SMILES
CCCCCCCCC[N+]1(CCCCC1)CC
InChI
InChI=1S/C16H34N/c1-3-5-6-7-8-9-11-14-17(4-2)15-12-10-13-16-17/h3-16H2,1-2H3/q+1
InChIKey
SYOZCCYVTKHLLJ-UHFFFAOYSA-N
Compound name
1-ethyl-1-nonylpiperidin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.26912 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.27640 163.8
[M+Na]+ 263.25834 165.9
[M-H]- 239.26184 164.0
[M+NH4]+ 258.30294 181.9
[M+K]+ 279.23228 157.7
[M+H-H2O]+ 223.26638 159.6
[M+HCOO]- 285.26732 180.0
[M+CH3COO]- 299.28297 189.7
[M+Na-2H]- 261.24379 168.5
[M]+ 240.26857 161.0
[M]- 240.26967 161.0
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.