CID 690805

1-(2,3-dichlorophenyliminomethyl)-2-naphthol

Structural Information

Molecular Formula

C₁₇H₁₁Cl₂NO

SMILES

C1=CC=C2C(=C1)C=CC(=C2C=NC3=C(C(=CC=C3)Cl)Cl)O

InChI

InChI=1S/C17H11Cl2NO/c18-14-6-3-7-15(17(14)19)20-10-13-12-5-2-1-4-11(12)8-9-16(13)21/h1-10,21H

InChIKey

GPKDOQXGDFCIMD-UHFFFAOYSA-N

Compound name

1-[(2,3-dichlorophenyl)iminomethyl]naphthalen-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 315.02176 Da
Monoisotopic Mass: 5.4
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]+	316.029036	168.7
[M+Na]+	338.010978	179.9
[M-H]-	314.014484	176.0
[M+NH4]+	333.055583	185.8
[M+K]+	353.984918	171.8
[M+H-H2O]+	298.019020	162.4
[M+HCOO]-	360.019961	183.6
[M+CH3COO]-	374.035611	180.9
[M+Na-2H]-	335.996426	174.4
[M]+	315.02121142	172.9
[M]-	315.02230858	172.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.