CID 62070564

2-amino-2-cyclopentylacetonitrile hydrochloride

Structural Information

Molecular Formula

C₇H₁₂N₂

SMILES

C1CCC(C1)C(C#N)N

InChI

InChI=1S/C7H12N2/c8-5-7(9)6-3-1-2-4-6/h6-7H,1-4,9H2

InChIKey

WOPVVVYENHYREL-UHFFFAOYSA-N

Compound name

2-amino-2-cyclopentylacetonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 124.10005 Da
Monoisotopic Mass: 0.9
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]+	125.10733	130.7
[M+Na]+	147.08927	138.8
[M+NH4]+	142.13387	135.9
[M+K]+	163.06321	132.2
[M-H]-	123.09277	125.1
[M+Na-2H]-	145.07472	132.4
[M]+	124.09950	129.1
[M]-	124.10060	129.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.