CID 69176948

1-ethyl-3-azabicyclo[3.1.0]hexane hydrochloride

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

CCC12CC1CNC2

InChI

InChI=1S/C7H13N/c1-2-7-3-6(7)4-8-5-7/h6,8H,2-5H2,1H3

InChIKey

ZAPBJKNMYYDVGK-UHFFFAOYSA-N

Compound name

1-ethyl-3-azabicyclo[3.1.0]hexane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 111.1048 Da
Monoisotopic Mass: 1.0
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]+	112.11208	125.9
[M+Na]+	134.09402	137.6
[M+NH4]+	129.13862	137.3
[M+K]+	150.06796	132.7
[M-H]-	110.09752	133.8
[M+Na-2H]-	132.07947	133.9
[M]+	111.10425	130.9
[M]-	111.10535	130.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe