CID 5391769

297145-92-7

Structural Information

Molecular Formula
C22H24N2O2
SMILES
CC1CCN(CC1)C(=O)/C(=C\C2=CC=CC=C2)/NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C22H24N2O2/c1-17-12-14-24(15-13-17)22(26)20(16-18-8-4-2-5-9-18)23-21(25)19-10-6-3-7-11-19/h2-11,16-17H,12-15H2,1H3,(H,23,25)/b20-16+
InChIKey
FVVQRPYEYYMCPZ-CAPFRKAQSA-N
Compound name
N-[(E)-3-(4-methylpiperidin-1-yl)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

348.18378 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.191056 185.4
[M+Na]+ 371.172998 186.6
[M-H]- 347.176504 191.8
[M+NH4]+ 366.217603 195.3
[M+K]+ 387.146938 181.6
[M+H-H2O]+ 331.181040 174.8
[M+HCOO]- 393.181981 201.7
[M+CH3COO]- 407.197631 214.0
[M+Na-2H]- 369.158446 185.0
[M]+ 348.18323142 179.0
[M]- 348.18432858 179.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.