CID 3061910

2-(methylimino-(2-chlorophenyl)methyl)-4-chlorophenol

Structural Information

Molecular Formula

C₁₄H₁₁Cl₂NO

SMILES

CN=C(C1=CC=CC=C1Cl)C2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C14H11Cl2NO/c1-17-14(10-4-2-3-5-12(10)16)11-8-9(15)6-7-13(11)18/h2-8,18H,1H3

InChIKey

IQMGFDPORRRUSO-UHFFFAOYSA-N

Compound name

4-chloro-2-[C-(2-chlorophenyl)-N-methylcarbonimidoyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 279.02176 Da
Monoisotopic Mass: 4.3
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]+	280.029036	159.0
[M+Na]+	302.010978	168.9
[M-H]-	278.014484	165.5
[M+NH4]+	297.055583	176.4
[M+K]+	317.984918	162.2
[M+H-H2O]+	262.019020	153.5
[M+HCOO]-	324.019961	174.2
[M+CH3COO]-	338.035611	199.9
[M+Na-2H]-	299.996426	162.8
[M]+	279.02121142	162.2
[M]-	279.02230858	162.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.