CID 6068545

Benzamide, n-(4-phenyl-1-(piperidinylcarbonyl)-1,3-butadienyl)-, (e,?)-

Structural Information

Molecular Formula
C23H24N2O2
SMILES
C1CCN(CC1)C(=O)/C(=C\C=C\C2=CC=CC=C2)/NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H24N2O2/c26-22(20-14-6-2-7-15-20)24-21(23(27)25-17-8-3-9-18-25)16-10-13-19-11-4-1-5-12-19/h1-2,4-7,10-16H,3,8-9,17-18H2,(H,24,26)/b13-10+,21-16+
InChIKey
PUBXRSITLISZHE-UPPKGELVSA-N
Compound name
N-[(2E,4E)-1-oxo-5-phenyl-1-piperidin-1-ylpenta-2,4-dien-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

360.18378 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.191056 188.9
[M+Na]+ 383.172998 189.1
[M-H]- 359.176504 194.7
[M+NH4]+ 378.217603 197.9
[M+K]+ 399.146938 183.2
[M+H-H2O]+ 343.181040 178.0
[M+HCOO]- 405.181981 205.0
[M+CH3COO]- 419.197631 214.4
[M+Na-2H]- 381.158446 188.7
[M]+ 360.18323142 181.6
[M]- 360.18432858 181.6
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.