CID 6898830

6662-53-9

Structural Information

Molecular Formula

C₈H₆Cl₂N₂O₂

SMILES

C1=CC(=C(C=C1NC(=O)/C=N/O)Cl)Cl

InChI

InChI=1S/C8H6Cl2N2O2/c9-6-2-1-5(3-7(6)10)12-8(13)4-11-14/h1-4,14H,(H,12,13)/b11-4+

InChIKey

DHNYOOWCULCVEH-NYYWCZLTSA-N

Compound name

(2E)-N-(3,4-dichlorophenyl)-2-hydroxyiminoacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 231.98064 Da
Monoisotopic Mass: 3.9
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]+	232.98792	144.8
[M+Na]+	254.96986	154.3
[M-H]-	230.97336	148.4
[M+NH4]+	250.01446	163.7
[M+K]+	270.94380	149.4
[M+H-H2O]+	214.97790	140.7
[M+HCOO]-	276.97884	162.0
[M+CH3COO]-	290.99449	190.7
[M+Na-2H]-	252.95531	150.1
[M]+	231.98009	147.5
[M]-	231.98119	147.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe