CID 69930

795-43-7

Structural Information

Molecular Formula

C₁₈H₁₅O₃P

SMILES

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

InChI

InChI=1S/C18H15O3P/c19-14-6-10-17(11-7-14)22(21,16-4-2-1-3-5-16)18-12-8-15(20)9-13-18/h1-13,19-20H

InChIKey

FYXPKOPFEGFWHG-UHFFFAOYSA-N

Compound name

4-[(4-hydroxyphenyl)-phenylphosphoryl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 683
Patents: 310.07587 Da
Monoisotopic Mass: 2.1
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]+	311.08315	172.3
[M+Na]+	333.06509	187.5
[M+NH4]+	328.10969	180.1
[M+K]+	349.03903	180.1
[M-H]-	309.06859	177.6
[M+Na-2H]-	331.05054	183.0
[M]+	310.07532	176.1
[M]-	310.07642	176.1

Literature stripe

literature stripe

Patent stripe

patents stripe