CID 54713739

[2,6-bis[(di-1-piperidinylphosphino)amino]phenyl]palladium(ii) chloride

Structural Information

Molecular Formula
C26H46N6P2
SMILES
C1CCN(CC1)P(NC2=CC(=CC=C2)NP(N3CCCCC3)N4CCCCC4)N5CCCCC5
InChI
InChI=1S/C26H46N6P2/c1-5-16-29(17-6-1)33(30-18-7-2-8-19-30)27-25-14-13-15-26(24-25)28-34(31-20-9-3-10-21-31)32-22-11-4-12-23-32/h13-15,24,27-28H,1-12,16-23H2
InChIKey
RSAGYLGCQULSNT-UHFFFAOYSA-N
Compound name
1-N,3-N-bis[di(piperidin-1-yl)phosphanyl]benzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

504.32593 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 505.33321 213.8
[M+Na]+ 527.31515 202.3
[M-H]- 503.31865 214.6
[M+NH4]+ 522.35975 211.1
[M+K]+ 543.28909 197.6
[M+H-H2O]+ 487.32319 192.2
[M+HCOO]- 549.32413 224.1
[M+CH3COO]- 563.33978 246.9
[M+Na-2H]- 525.30060 201.2
[M]+ 504.32538 192.2
[M]- 504.32648 192.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.