CID 6913732

1-(3-chloro-4-phenyl-2-butenyl)piperidine hydrochloride

Structural Information

Molecular Formula
C15H20ClN
SMILES
C1CCN(CC1)C/C=C(/CC2=CC=CC=C2)\Cl
InChI
InChI=1S/C15H20ClN/c16-15(13-14-7-3-1-4-8-14)9-12-17-10-5-2-6-11-17/h1,3-4,7-9H,2,5-6,10-13H2/b15-9-
InChIKey
APLOPYXUKPMEQX-DHDCSXOGSA-N
Compound name
1-[(Z)-3-chloro-4-phenylbut-2-enyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.12843 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.13571 159.6
[M+Na]+ 272.11765 173.0
[M+NH4]+ 267.16225 169.1
[M+K]+ 288.09159 163.6
[M-H]- 248.12115 163.9
[M+Na-2H]- 270.10310 167.6
[M]+ 249.12788 163.0
[M]- 249.12898 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.