CID 209484

2-(p-chloro-alpha-cyclohexylbenzyl)-3-piperidinol hydrochloride

Structural Information

Molecular Formula
C18H26ClNO
SMILES
C1CCC(CC1)C(C2C(CCCN2)O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H26ClNO/c19-15-10-8-14(9-11-15)17(13-5-2-1-3-6-13)18-16(21)7-4-12-20-18/h8-11,13,16-18,20-21H,1-7,12H2
InChIKey
LYNUXBUAWCJSOE-UHFFFAOYSA-N
Compound name
2-[(4-chlorophenyl)-cyclohexylmethyl]piperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.1703 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.17758 174.8
[M+Na]+ 330.15952 176.2
[M-H]- 306.16302 177.9
[M+NH4]+ 325.20412 186.7
[M+K]+ 346.13346 169.4
[M+H-H2O]+ 290.16756 166.3
[M+HCOO]- 352.16850 180.7
[M+CH3COO]- 366.18415 181.8
[M+Na-2H]- 328.14497 173.0
[M]+ 307.16975 164.6
[M]- 307.17085 164.6
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.