CID 54713739

955035-37-7

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 225.4
[M+Na]+ 527.31515 230.8
[M+NH4]+ 522.35975 230.8
[M+K]+ 543.28909 224.0
[M-H]- 503.31865 232.8
[M+Na-2H]- 525.30060 230.3
[M]+ 504.32538 227.5
[M]- 504.32648 227.5
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.