CID 9570325

N-(alpha-(1-methyl-1-piperidinoethyl)benzilidene)cinnamamide monohydrochloride

Structural Information

Molecular Formula
C24H28N2O
SMILES
CC(C)(C(=NC(=O)/C=C/C1=CC=CC=C1)C2=CC=CC=C2)N3CCCCC3
InChI
InChI=1S/C24H28N2O/c1-24(2,26-18-10-5-11-19-26)23(21-14-8-4-9-15-21)25-22(27)17-16-20-12-6-3-7-13-20/h3-4,6-9,12-17H,5,10-11,18-19H2,1-2H3/b17-16+,25-23?
InChIKey
NAKBZKBDZFDVNS-KPTHTWDUSA-N
Compound name
(E)-N-(2-methyl-1-phenyl-2-piperidin-1-ylpropylidene)-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.22015 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.22743 191.3
[M+Na]+ 383.20937 203.1
[M+NH4]+ 378.25397 198.5
[M+K]+ 399.18331 194.7
[M-H]- 359.21287 197.0
[M+Na-2H]- 381.19482 200.4
[M]+ 360.21960 194.5
[M]- 360.22070 194.5
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.