CID 256745

1-(3,9-dioxido-9-(1-piperidinyl)-2,4,8,10-tetraoxa-3,9-diphosphaspiro(5.5)undec-3-yl)piperidine

Structural Information

Molecular Formula
C15H28N2O6P2
SMILES
C1CCN(CC1)P2(=O)OCC3(CO2)COP(=O)(OC3)N4CCCCC4
InChI
InChI=1S/C15H28N2O6P2/c18-24(16-7-3-1-4-8-16)20-11-15(12-21-24)13-22-25(19,23-14-15)17-9-5-2-6-10-17/h1-14H2
InChIKey
HDYBUFLQGBXAFG-UHFFFAOYSA-N
Compound name
3,9-di(piperidin-1-yl)-2,4,8,10-tetraoxa-3lambda5,9lambda5-diphosphaspiro[5.5]undecane 3,9-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.14227 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.14955 192.6
[M+Na]+ 417.13149 192.4
[M-H]- 393.13499 198.1
[M+NH4]+ 412.17609 200.2
[M+K]+ 433.10543 197.0
[M+H-H2O]+ 377.13953 176.5
[M+HCOO]- 439.14047 206.1
[M+CH3COO]- 453.15612 214.8
[M+Na-2H]- 415.11694 190.3
[M]+ 394.14172 183.6
[M]- 394.14282 183.6
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.