CID 10609474

118289-55-7

Structural Information

Molecular Formula

C₁₀H₉Cl₂NO

SMILES

C1C2=CC(=C(C=C2NC1=O)Cl)CCCl

InChI

InChI=1S/C10H9Cl2NO/c11-2-1-6-3-7-4-10(14)13-9(7)5-8(6)12/h3,5H,1-2,4H2,(H,13,14)

InChIKey

ZTQQXEPZEYIVDK-UHFFFAOYSA-N

Compound name

6-chloro-5-(2-chloroethyl)-1,3-dihydroindol-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 213
Patents: 229.00612 Da
Monoisotopic Mass: 2.3
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]+	230.01340	144.1
[M+Na]+	251.99534	158.2
[M+NH4]+	247.03994	153.4
[M+K]+	267.96928	151.8
[M-H]-	227.99884	145.4
[M+Na-2H]-	249.98079	149.2
[M]+	229.00557	147.0
[M]-	229.00667	147.0

Literature stripe

literature stripe

Patent stripe

patents stripe