CID 619022

93324-84-6

Structural Information

Molecular Formula

C₁₇H₁₃NO

SMILES

C1=CC=C2C(=C1)C=CC=C2N=CC3=CC=C(C=C3)O

InChI

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

InChIKey

GWZBECWYBXRWNF-UHFFFAOYSA-N

Compound name

4-(naphthalen-1-yliminomethyl)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 247.09972 Da
Monoisotopic Mass: 3.9
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	154.2
[M+Na]+	270.088938	162.3
[M-H]-	246.092444	162.0
[M+NH4]+	265.133543	172.1
[M+K]+	286.062878	156.9
[M+H-H2O]+	230.096980	146.2
[M+HCOO]-	292.097921	178.8
[M+CH3COO]-	306.113571	167.0
[M+Na-2H]-	268.074386	162.9
[M]+	247.09917142	153.7
[M]-	247.10026858	153.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe