CID 18462039

80501-45-7

Structural Information

Molecular Formula

C₆H₁₀N₂

SMILES

C1CC(C(C1)N)C#N

InChI

InChI=1S/C6H10N2/c7-4-5-2-1-3-6(5)8/h5-6H,1-3,8H2

InChIKey

HERJCJRIDHRCKG-UHFFFAOYSA-N

Compound name

2-aminocyclopentane-1-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 51
Patents: 110.0844 Da
Monoisotopic Mass: 0.5
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]+	111.09168	123.1
[M+Na]+	133.07362	132.0
[M-H]-	109.07712	126.0
[M+NH4]+	128.11822	144.8
[M+K]+	149.04756	129.8
[M+H-H2O]+	93.081660	111.4
[M+HCOO]-	155.08260	143.2
[M+CH3COO]-	169.09825	183.1
[M+Na-2H]-	131.05907	127.2
[M]+	110.08385	113.9
[M]-	110.08495	113.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe