CID 65775

Prodipine

Structural Information

Molecular Formula
C20H25N
SMILES
CC(C)N1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H25N/c1-17(2)21-15-13-20(14-16-21,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,17H,13-16H2,1-2H3
InChIKey
CFOOTBBXHJHHMT-UHFFFAOYSA-N
Compound name
4,4-diphenyl-1-propan-2-ylpiperidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

945
Patents

279.1987 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.205976 170.0
[M+Na]+ 302.187918 173.8
[M-H]- 278.191424 176.9
[M+NH4]+ 297.232523 185.5
[M+K]+ 318.161858 168.9
[M+H-H2O]+ 262.195960 160.0
[M+HCOO]- 324.196901 187.0
[M+CH3COO]- 338.212551 179.7
[M+Na-2H]- 300.173366 173.1
[M]+ 279.19815142 164.5
[M]- 279.19924858 164.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe