CID 3064215

101997-62-0

Structural Information

Molecular Formula
C23H28N2O4
SMILES
CCNC(=O)N1C(CC(=O)C(C1C2=CC=C(C=C2)OC)C)C3=CC=C(C=C3)OC
InChI
InChI=1S/C23H28N2O4/c1-5-24-23(27)25-20(16-6-10-18(28-3)11-7-16)14-21(26)15(2)22(25)17-8-12-19(29-4)13-9-17/h6-13,15,20,22H,5,14H2,1-4H3,(H,24,27)
InChIKey
QWBPPHYOMDHWMW-UHFFFAOYSA-N
Compound name
N-ethyl-2,6-bis(4-methoxyphenyl)-3-methyl-4-oxopiperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.2049 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.21218 197.5
[M+Na]+ 419.19412 202.8
[M-H]- 395.19762 205.5
[M+NH4]+ 414.23872 207.0
[M+K]+ 435.16806 198.9
[M+H-H2O]+ 379.20216 186.9
[M+HCOO]- 441.20310 215.5
[M+CH3COO]- 455.21875 227.3
[M+Na-2H]- 417.17957 195.5
[M]+ 396.20435 198.4
[M]- 396.20545 198.4
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.