CID 99263

Piperidine, 1,1'-(o-chlorobenzylidene)di-

Structural Information

Molecular Formula
C17H25ClN2
SMILES
C1CCN(CC1)C(C2=CC=CC=C2Cl)N3CCCCC3
InChI
InChI=1S/C17H25ClN2/c18-16-10-4-3-9-15(16)17(19-11-5-1-6-12-19)20-13-7-2-8-14-20/h3-4,9-10,17H,1-2,5-8,11-14H2
InChIKey
JHVCQIAKEPKKMP-UHFFFAOYSA-N
Compound name
1-[(2-chlorophenyl)-piperidin-1-ylmethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.17062 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.17790 171.5
[M+Na]+ 315.15984 173.1
[M-H]- 291.16334 175.5
[M+NH4]+ 310.20444 183.6
[M+K]+ 331.13378 167.4
[M+H-H2O]+ 275.16788 160.8
[M+HCOO]- 337.16882 179.0
[M+CH3COO]- 351.18447 179.1
[M+Na-2H]- 313.14529 171.6
[M]+ 292.17007 163.0
[M]- 292.17117 163.0
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.