CID 377682

Nsc659262

Structural Information

Molecular Formula

C₁₀H₂₀N₂

SMILES

C1CC2CCC1CN(C2)CCN

InChI

InChI=1S/C10H20N2/c11-5-6-12-7-9-1-2-10(8-12)4-3-9/h9-10H,1-8,11H2

InChIKey

CMDZCNVXUJPTRB-UHFFFAOYSA-N

Compound name

2-(3-azabicyclo[3.2.2]nonan-3-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 168.16264 Da
Monoisotopic Mass: 0.8
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]+	169.16992	144.8
[M+Na]+	191.15186	151.5
[M-H]-	167.15536	144.7
[M+NH4]+	186.19646	165.3
[M+K]+	207.12580	148.8
[M+H-H2O]+	151.15990	144.4
[M+HCOO]-	213.16084	155.9
[M+CH3COO]-	227.17649	154.3
[M+Na-2H]-	189.13731	154.1
[M]+	168.16209	141.6
[M]-	168.16319	141.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe