CID 318597

35193-69-2

Structural Information

Molecular Formula

C₂₁H₁₆O₂

SMILES

COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)O

InChI

InChI=1S/C21H16O2/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)20-16-8-4-2-6-14(16)10-12-18(20)22/h2-13,22H,1H3

InChIKey

SYSSVMYYSHYMAQ-UHFFFAOYSA-N

Compound name

1-(2-methoxynaphthalen-1-yl)naphthalen-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 22
Patents: 300.11502 Da
Monoisotopic Mass: 5.7
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]+	301.12230	169.5
[M+Na]+	323.10424	189.1
[M+NH4]+	318.14884	180.3
[M+K]+	339.07818	178.2
[M-H]-	299.10774	176.9
[M+Na-2H]-	321.08969	180.8
[M]+	300.11447	175.0
[M]-	300.11557	175.0

Literature stripe

literature stripe

Patent stripe

patents stripe