CID 5305650

2-cyclopentylethanamine

Structural Information

Molecular Formula

C₇H₁₅N

SMILES

C1CCC(C1)CCN

InChI

InChI=1S/C7H15N/c8-6-5-7-3-1-2-4-7/h7H,1-6,8H2

InChIKey

UKPLRVAKKXWITN-UHFFFAOYSA-N

Compound name

2-cyclopentylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 602
Patents: 113.12045 Da
Monoisotopic Mass: 1.8
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]+	114.12773	125.6
[M+Na]+	136.10967	130.7
[M-H]-	112.11317	128.0
[M+NH4]+	131.15427	149.3
[M+K]+	152.08361	129.7
[M+H-H2O]+	96.117710	120.2
[M+HCOO]-	158.11865	148.9
[M+CH3COO]-	172.13430	170.3
[M+Na-2H]-	134.09512	129.8
[M]+	113.11990	120.7
[M]-	113.12100	120.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe