CID 162056

Phenaridine

Structural Information

Molecular Formula
C24H32N2O
SMILES
CCC(=O)N(C1CC(N(CC1C)CCC2=CC=CC=C2)C)C3=CC=CC=C3
InChI
InChI=1S/C24H32N2O/c1-4-24(27)26(22-13-9-6-10-14-22)23-17-20(3)25(18-19(23)2)16-15-21-11-7-5-8-12-21/h5-14,19-20,23H,4,15-18H2,1-3H3
InChIKey
ODPKHHGQKIYCTJ-UHFFFAOYSA-N
Compound name
N-[2,5-dimethyl-1-(2-phenylethyl)piperidin-4-yl]-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

358
Patents

364.25146 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.25874 193.3
[M+Na]+ 387.24068 195.6
[M-H]- 363.24418 201.2
[M+NH4]+ 382.28528 204.0
[M+K]+ 403.21462 191.0
[M+H-H2O]+ 347.24872 182.1
[M+HCOO]- 409.24966 210.7
[M+CH3COO]- 423.26531 224.5
[M+Na-2H]- 385.22613 191.8
[M]+ 364.25091 190.9
[M]- 364.25201 190.9
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