CID 67276

135-64-8

Structural Information

Molecular Formula

C₂₁H₁₅NO₂

SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)C3=CC4=CC=CC=C4C=C3O

InChI

InChI=1S/C21H15NO2/c23-20-13-17-8-4-3-7-16(17)12-19(20)21(24)22-18-10-9-14-5-1-2-6-15(14)11-18/h1-13,23H,(H,22,24)

InChIKey

PMYDPQQPEAYXKD-UHFFFAOYSA-N

Compound name

3-hydroxy-N-naphthalen-2-ylnaphthalene-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 11825
Patents: 313.1103 Da
Monoisotopic Mass: 5.5
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]+	314.11758	170.8
[M+Na]+	336.09952	179.3
[M-H]-	312.10302	178.4
[M+NH4]+	331.14412	186.1
[M+K]+	352.07346	172.8
[M+H-H2O]+	296.10756	162.1
[M+HCOO]-	358.10850	192.6
[M+CH3COO]-	372.12415	182.1
[M+Na-2H]-	334.08497	179.1
[M]+	313.10975	171.1
[M]-	313.11085	171.1

Literature stripe

literature stripe

Patent stripe

patents stripe