CID 99250

Phenyl dipiperidinophosphinate

Structural Information

Molecular Formula
C16H25N2O2P
SMILES
C1CCN(CC1)P(=O)(N2CCCCC2)OC3=CC=CC=C3
InChI
InChI=1S/C16H25N2O2P/c19-21(17-12-6-2-7-13-17,18-14-8-3-9-15-18)20-16-10-4-1-5-11-16/h1,4-5,10-11H,2-3,6-9,12-15H2
InChIKey
DBAVIWNSKXQGOD-UHFFFAOYSA-N
Compound name
1-[phenoxy(piperidin-1-yl)phosphoryl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

308.16537 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.17265 174.5
[M+Na]+ 331.15459 174.6
[M-H]- 307.15809 177.4
[M+NH4]+ 326.19919 185.1
[M+K]+ 347.12853 171.6
[M+H-H2O]+ 291.16263 161.2
[M+HCOO]- 353.16357 191.8
[M+CH3COO]- 367.17922 202.2
[M+Na-2H]- 329.14004 174.2
[M]+ 308.16482 166.2
[M]- 308.16592 166.2
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

patents stripe