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]+ 372.23218 194.8
[M+Na]+ 394.21412 196.6
[M-H]- 370.21762 202.5
[M+NH4]+ 389.25872 204.8
[M+K]+ 410.18806 189.6
[M+H-H2O]+ 354.22216 182.6
[M+HCOO]- 416.22310 209.4
[M+CH3COO]- 430.23875 201.7
[M+Na-2H]- 392.19957 196.5
[M]+ 371.22435 188.0
[M]- 371.22545 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.