CID 3064332

4-piperidinol, 4-(p-chlorophenyl)-1-(1-phenylcyclohexyl)-, hydrochloride

Structural Information

Molecular Formula
C23H28ClNO
SMILES
C1CCC(CC1)(C2=CC=CC=C2)N3CCC(CC3)(C4=CC=C(C=C4)Cl)O
InChI
InChI=1S/C23H28ClNO/c24-21-11-9-20(10-12-21)23(26)15-17-25(18-16-23)22(13-5-2-6-14-22)19-7-3-1-4-8-19/h1,3-4,7-12,26H,2,5-6,13-18H2
InChIKey
AEFPRCUGSWQBPF-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)-1-(1-phenylcyclohexyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.18594 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.19322 192.6
[M+Na]+ 392.17516 196.0
[M-H]- 368.17866 200.4
[M+NH4]+ 387.21976 206.0
[M+K]+ 408.14910 188.6
[M+H-H2O]+ 352.18320 181.3
[M+HCOO]- 414.18414 200.7
[M+CH3COO]- 428.19979 199.8
[M+Na-2H]- 390.16061 193.5
[M]+ 369.18539 184.5
[M]- 369.18649 184.5
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.