CID 75797

2-chloro-n-methyl-n-phenylacetamide

Structural Information

Molecular Formula

C₉H₁₀ClNO

SMILES

CN(C1=CC=CC=C1)C(=O)CCl

InChI

InChI=1S/C9H10ClNO/c1-11(9(12)7-10)8-5-3-2-4-6-8/h2-6H,7H2,1H3

InChIKey

VUOFGWLJEBESHL-UHFFFAOYSA-N

Compound name

2-chloro-N-methyl-N-phenylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 157
Patents: 183.04509 Da
Monoisotopic Mass: 1.7
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]+	184.05237	136.5
[M+Na]+	206.03431	149.6
[M+NH4]+	201.07891	145.8
[M+K]+	222.00825	142.7
[M-H]-	182.03781	139.6
[M+Na-2H]-	204.01976	144.5
[M]+	183.04454	139.5
[M]-	183.04564	139.5

Literature stripe

literature stripe

Patent stripe

patents stripe