CID 15566

1706-96-3

Structural Information

Molecular Formula

C₁₈H₁₅O₂P

SMILES

C1=CC=C(C=C1)OP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15O2P/c19-21(17-12-6-2-7-13-17,18-14-8-3-9-15-18)20-16-10-4-1-5-11-16/h1-15H

InChIKey

CIJWIJSYZZLMGD-UHFFFAOYSA-N

Compound name

diphenylphosphoryloxybenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1516
Patents: 294.08096 Da
Monoisotopic Mass: 4.4
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]+	295.08824	169.4
[M+Na]+	317.07018	175.3
[M-H]-	293.07368	177.4
[M+NH4]+	312.11478	184.0
[M+K]+	333.04412	170.8
[M+H-H2O]+	277.07822	158.1
[M+HCOO]-	339.07916	197.4
[M+CH3COO]-	353.09481	200.8
[M+Na-2H]-	315.05563	173.8
[M]+	294.08041	169.4
[M]-	294.08151	169.4

Literature stripe

literature stripe

Patent stripe

patents stripe