CID 55285034

1909309-64-3

Structural Information

Molecular Formula

C₈H₁₆N₂

SMILES

CN1CC2CCC1C(C2)N

InChI

InChI=1S/C8H16N2/c1-10-5-6-2-3-8(10)7(9)4-6/h6-8H,2-5,9H2,1H3

InChIKey

UWXQHWISDZPGAA-UHFFFAOYSA-N

Compound name

2-methyl-2-azabicyclo[2.2.2]octan-6-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 140.13135 Da
Monoisotopic Mass: 0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	141.138626	130.7
[M+Na]+	163.120568	135.5
[M-H]-	139.124074	125.9
[M+NH4]+	158.165173	155.3
[M+K]+	179.094508	133.6
[M+H-H2O]+	123.128610	126.1
[M+HCOO]-	185.129551	142.3
[M+CH3COO]-	199.145201	141.6
[M+Na-2H]-	161.106016	141.2
[M]+	140.13080142	128.8
[M]-	140.13189858	128.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe