CID 22245493

4-[(4-chlorophenyl)methyl]piperidin-4-ol hydrochloride

Structural Information

Molecular Formula
C12H16ClNO
SMILES
C1CNCCC1(CC2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C12H16ClNO/c13-11-3-1-10(2-4-11)9-12(15)5-7-14-8-6-12/h1-4,14-15H,5-9H2
InChIKey
TUWKKISRHRSDOB-UHFFFAOYSA-N
Compound name
4-[(4-chlorophenyl)methyl]piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

321
Patents

225.09204 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.09932 150.0
[M+Na]+ 248.08126 163.2
[M+NH4]+ 243.12586 160.4
[M+K]+ 264.05520 153.5
[M-H]- 224.08476 153.3
[M+Na-2H]- 246.06671 158.8
[M]+ 225.09149 153.2
[M]- 225.09259 153.2
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