CID 69448

N-1-naphthylbenzamide

Structural Information

Molecular Formula

C₁₇H₁₃NO

SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H13NO/c19-17(14-8-2-1-3-9-14)18-16-12-6-10-13-7-4-5-11-15(13)16/h1-12H,(H,18,19)

InChIKey

ALANUUFGKYEMNI-UHFFFAOYSA-N

Compound name

N-naphthalen-1-ylbenzamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 8
References: 136
Patents: 247.09972 Da
Monoisotopic Mass: 3.3
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]+	248.106996	154.5
[M+Na]+	270.088938	161.3
[M-H]-	246.092444	161.8
[M+NH4]+	265.133543	171.9
[M+K]+	286.062878	156.3
[M+H-H2O]+	230.096980	146.4
[M+HCOO]-	292.097921	178.0
[M+CH3COO]-	306.113571	166.7
[M+Na-2H]-	268.074386	162.6
[M]+	247.09917142	152.9
[M]-	247.10026858	152.9

Literature stripe

literature stripe

Patent stripe

patents stripe