CID 84078193

3-cyclopentylcyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula

C₉H₁₇N

SMILES

C1CCC(C1)C2CC(C2)N

InChI

InChI=1S/C9H17N/c10-9-5-8(6-9)7-3-1-2-4-7/h7-9H,1-6,10H2

InChIKey

IIVQSHRXGZKFJF-UHFFFAOYSA-N

Compound name

3-cyclopentylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 139.1361 Da
Monoisotopic Mass: 2.3
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]+	140.14338	128.4
[M+Na]+	162.12532	131.9
[M-H]-	138.12882	133.9
[M+NH4]+	157.16992	144.5
[M+K]+	178.09926	133.2
[M+H-H2O]+	122.13336	117.8
[M+HCOO]-	184.13430	149.3
[M+CH3COO]-	198.14995	179.1
[M+Na-2H]-	160.11077	130.7
[M]+	139.13555	130.6
[M]-	139.13665	130.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.