CID 2733414

1,5-bis(diphenylphosphino)pentane

Structural Information

Molecular Formula
C29H30P2
SMILES
C1=CC=C(C=C1)P(CCCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C29H30P2/c1-6-16-26(17-7-1)30(27-18-8-2-9-19-27)24-14-5-15-25-31(28-20-10-3-11-21-28)29-22-12-4-13-23-29/h1-4,6-13,16-23H,5,14-15,24-25H2
InChIKey
MZFPAWGWFDGCHP-UHFFFAOYSA-N
Compound name
5-diphenylphosphanylpentyl(diphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1724
Patents

440.18228 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.18956 217.7
[M+Na]+ 463.17150 217.3
[M-H]- 439.17500 224.6
[M+NH4]+ 458.21610 225.2
[M+K]+ 479.14544 209.9
[M+H-H2O]+ 423.17954 200.5
[M+HCOO]- 485.18048 245.7
[M+CH3COO]- 499.19613 233.8
[M+Na-2H]- 461.15695 210.1
[M]+ 440.18173 215.3
[M]- 440.18283 215.3
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