CID 4285986

Dichloro{bis[2-(diphenylphosphino)phenyl]ether}palladium(ii), 98%

Structural Information

Molecular Formula
C36H28OP2
SMILES
C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3OC4=CC=CC=C4P(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C36H28OP2/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32/h1-28H
InChIKey
RYXZOQOZERSHHQ-UHFFFAOYSA-N
Compound name
[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

21
References

7374
Patents

538.16156 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 539.16884 237.0
[M+Na]+ 561.15078 236.5
[M-H]- 537.15428 249.0
[M+NH4]+ 556.19538 238.8
[M+K]+ 577.12472 228.8
[M+H-H2O]+ 521.15882 216.8
[M+HCOO]- 583.15976 263.0
[M+CH3COO]- 597.17541 240.9
[M+Na-2H]- 559.13623 228.3
[M]+ 538.16101 231.4
[M]- 538.16211 231.4
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