CID 66718

92-76-2

Structural Information

Molecular Formula

C₁₈H₁₄ClNO₂

SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)C2=CC3=CC=CC=C3C=C2O

InChI

InChI=1S/C18H14ClNO2/c1-11-8-14(19)6-7-16(11)20-18(22)15-9-12-4-2-3-5-13(12)10-17(15)21/h2-10,21H,1H3,(H,20,22)

InChIKey

PSRNXESQSJEQMN-UHFFFAOYSA-N

Compound name

N-(4-chloro-2-methylphenyl)-3-hydroxynaphthalene-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 165
Patents: 311.07132 Da
Monoisotopic Mass: 5.2
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]+	312.07860	170.2
[M+Na]+	334.06054	186.7
[M+NH4]+	329.10514	179.5
[M+K]+	350.03448	177.7
[M-H]-	310.06404	176.1
[M+Na-2H]-	332.04599	179.3
[M]+	311.07077	174.7
[M]-	311.07187	174.7

Literature stripe

literature stripe

Patent stripe

patents stripe