CID 53750

C 2102

Structural Information

Molecular Formula
C20H32N2O2
SMILES
CCN(C(C)COC1=C(C=C(C=C1)C)C)C(=O)CN2CCCCC2
InChI
InChI=1S/C20H32N2O2/c1-5-22(20(23)14-21-11-7-6-8-12-21)18(4)15-24-19-10-9-16(2)13-17(19)3/h9-10,13,18H,5-8,11-12,14-15H2,1-4H3
InChIKey
YESWQBWCRYHWPM-UHFFFAOYSA-N
Compound name
N-[1-(2,4-dimethylphenoxy)propan-2-yl]-N-ethyl-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.24637 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.253646 184.8
[M+Na]+ 355.235588 186.4
[M-H]- 331.239094 189.6
[M+NH4]+ 350.280193 197.1
[M+K]+ 371.209528 184.5
[M+H-H2O]+ 315.243630 175.2
[M+HCOO]- 377.244571 201.6
[M+CH3COO]- 391.260221 218.6
[M+Na-2H]- 353.221036 182.6
[M]+ 332.24582142 184.3
[M]- 332.24691858 184.3
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.