CID 4183961

Tris(4-hydroxyphenyl)phosphine oxide

Structural Information

Molecular Formula
C18H15O4P
SMILES
C1=CC(=CC=C1O)P(=O)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O
InChI
InChI=1S/C18H15O4P/c19-13-1-7-16(8-2-13)23(22,17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12,19-21H
InChIKey
LMBQOLBVWODAFG-UHFFFAOYSA-N
Compound name
4-bis(4-hydroxyphenyl)phosphorylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

544
Patents

326.0708 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.07808 176.0
[M+Na]+ 349.06002 182.8
[M-H]- 325.06352 181.1
[M+NH4]+ 344.10462 187.9
[M+K]+ 365.03396 177.7
[M+H-H2O]+ 309.06806 165.6
[M+HCOO]- 371.06900 199.8
[M+CH3COO]- 385.08465 201.4
[M+Na-2H]- 347.04547 177.5
[M]+ 326.07025 174.5
[M]- 326.07135 174.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.