CID 28294585

1955541-36-2

Structural Information

Molecular Formula

C₈H₁₈N₂

SMILES

CN(C)CC1(CCCC1)N

InChI

InChI=1S/C8H18N2/c1-10(2)7-8(9)5-3-4-6-8/h3-7,9H2,1-2H3

InChIKey

VDNIFMDAQBGJGP-UHFFFAOYSA-N

Compound name

1-[(dimethylamino)methyl]cyclopentan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 142.147 Da
Monoisotopic Mass: 0.4
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]+	143.15428	132.6
[M+Na]+	165.13622	137.6
[M-H]-	141.13972	136.6
[M+NH4]+	160.18082	157.5
[M+K]+	181.11016	137.7
[M+H-H2O]+	125.14426	127.3
[M+HCOO]-	187.14520	157.1
[M+CH3COO]-	201.16085	181.2
[M+Na-2H]-	163.12167	137.0
[M]+	142.14645	128.9
[M]-	142.14755	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe