CID 88440

20266-00-6

Structural Information

Molecular Formula

C₆H₁₀ClNO

SMILES

C1CCN(C1)C(=O)CCl

InChI

InChI=1S/C6H10ClNO/c7-5-6(9)8-3-1-2-4-8/h1-5H2

InChIKey

AAOSLLBWWRKJIR-UHFFFAOYSA-N

Compound name

2-chloro-1-pyrrolidin-1-ylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 746
Patents: 147.04509 Da
Monoisotopic Mass: 0.8
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]+	148.05237	128.8
[M+Na]+	170.03431	139.3
[M+NH4]+	165.07891	137.5
[M+K]+	186.00825	135.2
[M-H]-	146.03781	129.2
[M+Na-2H]-	168.01976	133.3
[M]+	147.04454	130.4
[M]-	147.04564	130.4

Literature stripe

literature stripe

Patent stripe

patents stripe