CID 151441

(2-(2-pyridyl)ethyl)diethylmethylammonium

Structural Information

Molecular Formula
C12H21N2
SMILES
CC[N+](C)(CC)CCC1=CC=CC=N1
InChI
InChI=1S/C12H21N2/c1-4-14(3,5-2)11-9-12-8-6-7-10-13-12/h6-8,10H,4-5,9,11H2,1-3H3/q+1
InChIKey
WZXGSKIGSSEPSE-UHFFFAOYSA-N
Compound name
diethyl-methyl-(2-pyridin-2-ylethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

193.17047 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.17775 144.1
[M+Na]+ 216.15969 150.2
[M-H]- 192.16319 147.5
[M+NH4]+ 211.20429 162.9
[M+K]+ 232.13363 143.1
[M+H-H2O]+ 176.16773 140.0
[M+HCOO]- 238.16867 166.9
[M+CH3COO]- 252.18432 184.5
[M+Na-2H]- 214.14514 154.7
[M]+ 193.16992 144.6
[M]- 193.17102 144.6
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.