CID 307021

2,4-dichloro-n-(naphthalen-1-yl)benzamide

Structural Information

Molecular Formula

C₁₇H₁₁Cl₂NO

SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

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

InChIKey

SGTGBXYUCAVUQC-UHFFFAOYSA-N

Compound name

2,4-dichloro-N-naphthalen-1-ylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 315.02176 Da
Monoisotopic Mass: 5.3
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]+	316.02904	168.8
[M+Na]+	338.01098	186.6
[M+NH4]+	333.05558	179.1
[M+K]+	353.98492	176.0
[M-H]-	314.01448	175.3
[M+Na-2H]-	335.99643	179.2
[M]+	315.02121	174.1
[M]-	315.02231	174.1

Literature stripe

literature stripe

Patent stripe

patents stripe