CID 23329

Triethyl(2-(2-pyridyl)ethyl)ammonium iodide

Structural Information

Molecular Formula
C13H23N2
SMILES
CC[N+](CC)(CC)CCC1=CC=CC=N1
InChI
InChI=1S/C13H23N2/c1-4-15(5-2,6-3)12-10-13-9-7-8-11-14-13/h7-9,11H,4-6,10,12H2,1-3H3/q+1
InChIKey
GWOWAZWLTCJXRX-UHFFFAOYSA-N
Compound name
triethyl(2-pyridin-2-ylethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

207.18613 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.19341 148.8
[M+Na]+ 230.17535 154.5
[M-H]- 206.17885 152.1
[M+NH4]+ 225.21995 167.0
[M+K]+ 246.14929 147.1
[M+H-H2O]+ 190.18339 144.5
[M+HCOO]- 252.18433 171.3
[M+CH3COO]- 266.19998 187.6
[M+Na-2H]- 228.16080 158.9
[M]+ 207.18558 149.7
[M]- 207.18668 149.7
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.