CID 220741

3,4-dichlorobenzaldehyde oxime

Structural Information

Molecular Formula

C₇H₅Cl₂NO

SMILES

C1=CC(=C(C=C1C=NO)Cl)Cl

InChI

InChI=1S/C7H5Cl2NO/c8-6-2-1-5(4-10-11)3-7(6)9/h1-4,11H

InChIKey

ROBIUDOANJUDHD-UHFFFAOYSA-N

Compound name

N-[(3,4-dichlorophenyl)methylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 55
Patents: 188.97482 Da
Monoisotopic Mass: 3.1
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]+	189.98210	132.7
[M+Na]+	211.96404	147.4
[M+NH4]+	207.00864	142.2
[M+K]+	227.93798	139.5
[M-H]-	187.96754	135.6
[M+Na-2H]-	209.94949	140.8
[M]+	188.97427	136.2
[M]-	188.97537	136.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe