CID 4642097

1,2-bis(diphenylphosphinomethyl)benzene

Structural Information

Molecular Formula
C32H28P2
SMILES
C1=CC=C(C=C1)P(CC2=CC=CC=C2CP(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C32H28P2/c1-5-17-29(18-6-1)33(30-19-7-2-8-20-30)25-27-15-13-14-16-28(27)26-34(31-21-9-3-10-22-31)32-23-11-4-12-24-32/h1-24H,25-26H2
InChIKey
BZDNMSNFLZXRLY-UHFFFAOYSA-N
Compound name
[2-(diphenylphosphanylmethyl)phenyl]methyl-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

676
Patents

474.16663 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 475.17391 222.6
[M+Na]+ 497.15585 241.0
[M+NH4]+ 492.20045 232.0
[M+K]+ 513.12979 227.7
[M-H]- 473.15935 235.0
[M+Na-2H]- 495.14130 237.9
[M]+ 474.16608 229.2
[M]- 474.16718 229.2
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

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