CID 209530

19974-87-9

Structural Information

Molecular Formula
C25H27NO
SMILES
C1CC(C(N(C1)CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4)O
InChI
InChI=1S/C25H27NO/c27-23-17-10-18-26(19-20-11-4-1-5-12-20)25(23)24(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,23-25,27H,10,17-19H2
InChIKey
OUYSJLZYIJHWRC-UHFFFAOYSA-N
Compound name
2-benzhydryl-1-benzylpiperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.20926 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.216536 188.9
[M+Na]+ 380.198478 191.0
[M-H]- 356.201984 196.9
[M+NH4]+ 375.243083 197.8
[M+K]+ 396.172418 183.9
[M+H-H2O]+ 340.206520 177.2
[M+HCOO]- 402.207461 203.9
[M+CH3COO]- 416.223111 196.3
[M+Na-2H]- 378.183926 189.7
[M]+ 357.20871142 181.9
[M]- 357.20980858 181.9
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.