CID 3062431

98016-05-8

Structural Information

Molecular Formula
C19H22ClNO
SMILES
C1CCN(CC1)CC(C2=CC=CC=C2)(C3=CC(=CC=C3)Cl)O
InChI
InChI=1S/C19H22ClNO/c20-18-11-7-10-17(14-18)19(22,16-8-3-1-4-9-16)15-21-12-5-2-6-13-21/h1,3-4,7-11,14,22H,2,5-6,12-13,15H2
InChIKey
YWLCAVWQAIOESC-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-1-phenyl-2-piperidin-1-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.13898 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.14626 176.9
[M+Na]+ 338.12820 191.7
[M+NH4]+ 333.17280 186.1
[M+K]+ 354.10214 182.4
[M-H]- 314.13170 182.7
[M+Na-2H]- 336.11365 187.0
[M]+ 315.13843 181.2
[M]- 315.13953 181.2
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

No patent data available for this compound.