CID 8436002

2-[4-(2-ethoxyphenyl)piperazin-1-yl]-n-[(1s)-1-(furan-2-yl)ethyl]acetamide

Structural Information

Molecular Formula
C20H27N3O3
SMILES
CCOC1=CC=CC=C1N2CCN(CC2)CC(=O)N[C@@H](C)C3=CC=CO3
InChI
InChI=1S/C20H27N3O3/c1-3-25-19-8-5-4-7-17(19)23-12-10-22(11-13-23)15-20(24)21-16(2)18-9-6-14-26-18/h4-9,14,16H,3,10-13,15H2,1-2H3,(H,21,24)/t16-/m0/s1
InChIKey
VEJUREZYUWKIEC-INIZCTEOSA-N
Compound name
2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[(1S)-1-(furan-2-yl)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.20523 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.21251 187.4
[M+Na]+ 380.19445 189.9
[M-H]- 356.19795 193.9
[M+NH4]+ 375.23905 196.6
[M+K]+ 396.16839 187.5
[M+H-H2O]+ 340.20249 176.7
[M+HCOO]- 402.20343 203.7
[M+CH3COO]- 416.21908 215.8
[M+Na-2H]- 378.17990 186.5
[M]+ 357.20468 186.3
[M]- 357.20578 186.3
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.