CID 253998

1054-59-7

Structural Information

Molecular Formula
C24H20O2P2
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H20O2P2/c25-27(21-13-5-1-6-14-21,22-15-7-2-8-16-22)28(26,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKey
CUJMYQJVFIFJNS-UHFFFAOYSA-N
Compound name
[diphenylphosphoryl(phenyl)phosphoryl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

402.09384 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.10112 200.3
[M+Na]+ 425.08306 204.0
[M-H]- 401.08656 209.1
[M+NH4]+ 420.12766 209.7
[M+K]+ 441.05700 198.2
[M+H-H2O]+ 385.09110 184.6
[M+HCOO]- 447.09204 229.8
[M+CH3COO]- 461.10769 221.4
[M+Na-2H]- 423.06851 200.6
[M]+ 402.09329 198.0
[M]- 402.09439 198.0
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