CID 1518777

2-chloro-n-cyclopentylacetamide

Structural Information

Molecular Formula

C₇H₁₂ClNO

SMILES

C1CCC(C1)NC(=O)CCl

InChI

InChI=1S/C7H12ClNO/c8-5-7(10)9-6-3-1-2-4-6/h6H,1-5H2,(H,9,10)

InChIKey

SQWLIYWNXLKVGA-UHFFFAOYSA-N

Compound name

2-chloro-N-cyclopentylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 49
Patents: 161.06075 Da
Monoisotopic Mass: 1.4
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]+	162.06803	133.3
[M+Na]+	184.04997	142.5
[M+NH4]+	179.09457	142.2
[M+K]+	200.02391	138.3
[M-H]-	160.05347	134.7
[M+Na-2H]-	182.03542	137.7
[M]+	161.06020	134.9
[M]-	161.06130	134.9

Literature stripe

literature stripe

Patent stripe

patents stripe