CID 131697835

2387602-64-2

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C1C2CC1(C2)CCN

InChI

InChI=1S/C7H13N/c8-2-1-7-3-6(4-7)5-7/h6H,1-5,8H2

InChIKey

NPDNNRZPIXXZFH-UHFFFAOYSA-N

Compound name

2-(1-bicyclo[1.1.1]pentanyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 111.1048 Da
Monoisotopic Mass: 1.2
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	137.7
[M+Na]+	134.09402	134.8
[M+NH4]+	129.13862	137.5
[M+K]+	150.06796	133.3
[M-H]-	110.09752	131.7
[M+Na-2H]-	132.07947	134.1
[M]+	111.10425	132.9
[M]-	111.10535	132.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.