CID 3039660

Alpha-(4-biphenyl)-alpha-cyclohexyl-1-piperidinepropanol hydrochloride

Structural Information

Molecular Formula
C26H35NO
SMILES
C1CCC(CC1)C(CCN2CCCCC2)(C3=CC=C(C=C3)C4=CC=CC=C4)O
InChI
InChI=1S/C26H35NO/c28-26(24-12-6-2-7-13-24,18-21-27-19-8-3-9-20-27)25-16-14-23(15-17-25)22-10-4-1-5-11-22/h1,4-5,10-11,14-17,24,28H,2-3,6-9,12-13,18-21H2
InChIKey
XPOVRSYIPMDVDT-UHFFFAOYSA-N
Compound name
1-cyclohexyl-1-(4-phenylphenyl)-3-piperidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

377.27185 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.27913 195.5
[M+Na]+ 400.26107 193.8
[M-H]- 376.26457 201.8
[M+NH4]+ 395.30567 203.2
[M+K]+ 416.23501 187.1
[M+H-H2O]+ 360.26911 183.7
[M+HCOO]- 422.27005 205.2
[M+CH3COO]- 436.28570 200.7
[M+Na-2H]- 398.24652 195.4
[M]+ 377.27130 184.3
[M]- 377.27240 184.3
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