CID 11858339

2-[1-(2-phenoxyethyl)-3-piperidyl]-2,2-diphenyl-acetamide

Structural Information

Molecular Formula
C27H30N2O2
SMILES
C1CC(CN(C1)CCOC2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)N
InChI
InChI=1S/C27H30N2O2/c28-26(30)27(22-11-4-1-5-12-22,23-13-6-2-7-14-23)24-15-10-18-29(21-24)19-20-31-25-16-8-3-9-17-25/h1-9,11-14,16-17,24H,10,15,18-21H2,(H2,28,30)
InChIKey
HNRMWVAOMIULPG-UHFFFAOYSA-N
Compound name
2-[1-(2-phenoxyethyl)piperidin-3-yl]-2,2-diphenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

414.23074 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.23802 202.0
[M+Na]+ 437.21996 202.3
[M-H]- 413.22346 210.2
[M+NH4]+ 432.26456 208.2
[M+K]+ 453.19390 196.1
[M+H-H2O]+ 397.22800 189.6
[M+HCOO]- 459.22894 216.9
[M+CH3COO]- 473.24459 226.4
[M+Na-2H]- 435.20541 203.7
[M]+ 414.23019 195.7
[M]- 414.23129 195.7
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.