CID 3024513

4-piperidinemethanol, 1-(2,2-diphenylethyl)-4-phenyl-, hydrochloride

Structural Information

Molecular Formula
C26H29NO
SMILES
C1CN(CCC1(CO)C2=CC=CC=C2)CC(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H29NO/c28-21-26(24-14-8-3-9-15-24)16-18-27(19-17-26)20-25(22-10-4-1-5-11-22)23-12-6-2-7-13-23/h1-15,25,28H,16-21H2
InChIKey
JPJXTBNAIYMLET-UHFFFAOYSA-N
Compound name
[1-(2,2-diphenylethyl)-4-phenylpiperidin-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.2249 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.232176 194.8
[M+Na]+ 394.214118 196.6
[M-H]- 370.217624 202.5
[M+NH4]+ 389.258723 204.8
[M+K]+ 410.188058 189.6
[M+H-H2O]+ 354.222160 182.6
[M+HCOO]- 416.223101 209.4
[M+CH3COO]- 430.238751 201.7
[M+Na-2H]- 392.199566 196.5
[M]+ 371.22435142 188.0
[M]- 371.22544858 188.0
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.