CID 210004

20814-68-0

Structural Information

Molecular Formula
C21H25NO
SMILES
C=CCN1CCCC(C1C(C2=CC=CC=C2)C3=CC=CC=C3)O
InChI
InChI=1S/C21H25NO/c1-2-15-22-16-9-14-19(23)21(22)20(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h2-8,10-13,19-21,23H,1,9,14-16H2
InChIKey
UWOOUHOCAYKOFE-UHFFFAOYSA-N
Compound name
2-benzhydryl-1-prop-2-enylpiperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.1936 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.20088 178.0
[M+Na]+ 330.18282 192.0
[M+NH4]+ 325.22742 186.4
[M+K]+ 346.15676 182.8
[M-H]- 306.18632 184.0
[M+Na-2H]- 328.16827 186.9
[M]+ 307.19305 181.7
[M]- 307.19415 181.7
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.