CID 3025331

Propionanilide, n-(1-(1-phenylcyclohexyl)-4-piperidyl)-

Structural Information

Molecular Formula
C26H34N2O
SMILES
CCC(=O)N(C1CCN(CC1)C2(CCCCC2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H34N2O/c1-2-25(29)28(23-14-8-4-9-15-23)24-16-20-27(21-17-24)26(18-10-5-11-19-26)22-12-6-3-7-13-22/h3-4,6-9,12-15,24H,2,5,10-11,16-21H2,1H3
InChIKey
QZPDSVXAFFEZCJ-UHFFFAOYSA-N
Compound name
N-phenyl-N-[1-(1-phenylcyclohexyl)piperidin-4-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.26712 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.27440 201.5
[M+Na]+ 413.25634 213.7
[M+NH4]+ 408.30094 211.4
[M+K]+ 429.23028 202.3
[M-H]- 389.25984 210.4
[M+Na-2H]- 411.24179 212.6
[M]+ 390.26657 205.9
[M]- 390.26767 205.9
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.