CID 57640033

878155-47-6

Structural Information

Molecular Formula

C₈H₁₆N₂

SMILES

C1CC2CC1CN2CCN

InChI

InChI=1S/C8H16N2/c9-3-4-10-6-7-1-2-8(10)5-7/h7-8H,1-6,9H2

InChIKey

CLPVUDZYVCDMBZ-UHFFFAOYSA-N

Compound name

2-(2-azabicyclo[2.2.1]heptan-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
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	132.0
[M+Na]+	163.120568	138.4
[M-H]-	139.124074	132.7
[M+NH4]+	158.165173	156.9
[M+K]+	179.094508	136.7
[M+H-H2O]+	123.128610	126.4
[M+HCOO]-	185.129551	152.8
[M+CH3COO]-	199.145201	176.4
[M+Na-2H]-	161.106016	135.5
[M]+	140.13080142	128.6
[M]-	140.13189858	128.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe