CID 2783495

13291-46-8

Structural Information

Molecular Formula
C18H15O3P
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=C(C=CC(=C3)O)O
InChI
InChI=1S/C18H15O3P/c19-14-11-12-17(20)18(13-14)22(21,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,19-20H
InChIKey
LLOXZCFOAUCDAE-UHFFFAOYSA-N
Compound name
2-diphenylphosphorylbenzene-1,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1138
Patents

310.07587 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[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
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe