CID 457310

53151-10-3

Structural Information

Molecular Formula

C₁₇H₁₂FNO₂

SMILES

C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC(=CC=C3)F)O

InChI

InChI=1S/C17H12FNO2/c18-13-6-3-7-14(10-13)19-17(21)15-8-11-4-1-2-5-12(11)9-16(15)20/h1-10,20H,(H,19,21)

InChIKey

OXJWZFBWPDNPHK-UHFFFAOYSA-N

Compound name

N-(3-fluorophenyl)-3-hydroxynaphthalene-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 7
Patents: 281.0852 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]+	282.09248	161.2
[M+Na]+	304.07442	169.4
[M-H]-	280.07792	166.6
[M+NH4]+	299.11902	177.1
[M+K]+	320.04836	163.9
[M+H-H2O]+	264.08246	152.6
[M+HCOO]-	326.08340	182.4
[M+CH3COO]-	340.09905	172.8
[M+Na-2H]-	302.05987	166.9
[M]+	281.08465	159.2
[M]-	281.08575	159.2

Literature stripe

literature stripe

Patent stripe

patents stripe