CID 3048547

N-(1-methyl-2-(4-phenylpiperidino)ethyl)propionanilide oxalate

Structural Information

Molecular Formula
C23H30N2O
SMILES
CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCC(CC2)C3=CC=CC=C3
InChI
InChI=1S/C23H30N2O/c1-3-23(26)25(22-12-8-5-9-13-22)19(2)18-24-16-14-21(15-17-24)20-10-6-4-7-11-20/h4-13,19,21H,3,14-18H2,1-2H3
InChIKey
XZDOFWCUBHYDTJ-UHFFFAOYSA-N
Compound name
N-phenyl-N-[1-(4-phenylpiperidin-1-yl)propan-2-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2358 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.24308 189.1
[M+Na]+ 373.22502 201.3
[M+NH4]+ 368.26962 197.0
[M+K]+ 389.19896 193.0
[M-H]- 349.22852 195.7
[M+Na-2H]- 371.21047 197.9
[M]+ 350.23525 192.7
[M]- 350.23635 192.7
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.