CID 22741737

1-[(4-phenylpiperidin-4-yl)carbonyl]piperidine hydrochloride

Structural Information

Molecular Formula
C17H24N2O
SMILES
C1CCN(CC1)C(=O)C2(CCNCC2)C3=CC=CC=C3
InChI
InChI=1S/C17H24N2O/c20-16(19-13-5-2-6-14-19)17(9-11-18-12-10-17)15-7-3-1-4-8-15/h1,3-4,7-8,18H,2,5-6,9-14H2
InChIKey
COQXRYRBNZJUEW-UHFFFAOYSA-N
Compound name
(4-phenylpiperidin-4-yl)-piperidin-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

272.18887 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.196146 168.7
[M+Na]+ 295.178088 169.6
[M-H]- 271.181594 171.8
[M+NH4]+ 290.222693 181.8
[M+K]+ 311.152028 165.1
[M+H-H2O]+ 255.186130 158.3
[M+HCOO]- 317.187071 179.9
[M+CH3COO]- 331.202721 176.1
[M+Na-2H]- 293.163536 170.6
[M]+ 272.18832142 156.9
[M]- 272.18941858 156.9
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