CID 613006

Diphenylphosphinic anhydride

Structural Information

Molecular Formula
C24H20O3P2
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)OP(=O)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H20O3P2/c25-28(21-13-5-1-6-14-21,22-15-7-2-8-16-22)27-29(26,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKey
XTAYANNRWHXQOL-UHFFFAOYSA-N
Compound name
[diphenylphosphoryloxy(phenyl)phosphoryl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

153
Patents

418.08878 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.09606 202.9
[M+Na]+ 441.07800 206.4
[M-H]- 417.08150 211.7
[M+NH4]+ 436.12260 211.6
[M+K]+ 457.05194 201.4
[M+H-H2O]+ 401.08604 186.9
[M+HCOO]- 463.08698 232.6
[M+CH3COO]- 477.10263 223.4
[M+Na-2H]- 439.06345 203.6
[M]+ 418.08823 201.8
[M]- 418.08933 201.8
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