CID 24904912

1-(4-chlorobenzyl)piperidin-3-ol

Structural Information

Molecular Formula
C12H16ClNO
SMILES
C1CC(CN(C1)CC2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C12H16ClNO/c13-11-5-3-10(4-6-11)8-14-7-1-2-12(15)9-14/h3-6,12,15H,1-2,7-9H2
InChIKey
YUZVJHZMUZSPSQ-UHFFFAOYSA-N
Compound name
1-[(4-chlorophenyl)methyl]piperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.09204 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.09932 149.2
[M+Na]+ 248.08126 163.3
[M+NH4]+ 243.12586 158.6
[M+K]+ 264.05520 155.1
[M-H]- 224.08476 153.2
[M+Na-2H]- 246.06671 157.0
[M]+ 225.09149 152.7
[M]- 225.09259 152.7
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.