CID 113778

63716-77-8

Structural Information

Molecular Formula

C₁₄H₂₆N₂O₂

SMILES

CCN(CC)CCOC(=O)C1CC2CCN1CC2

InChI

InChI=1S/C14H26N2O2/c1-3-15(4-2)9-10-18-14(17)13-11-12-5-7-16(13)8-6-12/h12-13H,3-11H2,1-2H3

InChIKey

UOFIKNKQTSXENW-UHFFFAOYSA-N

Compound name

2-(diethylamino)ethyl 1-azabicyclo[2.2.2]octane-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 254.19943 Da
Monoisotopic Mass: 1.9
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]+	255.20671	157.9
[M+Na]+	277.18865	165.3
[M+NH4]+	272.23325	166.9
[M+K]+	293.16259	159.0
[M-H]-	253.19215	155.5
[M+Na-2H]-	275.17410	154.4
[M]+	254.19888	157.9
[M]-	254.19998	157.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.