CID 370648

4332-80-3

Structural Information

Molecular Formula

C₂₄H₂₃NO

SMILES

CN1CC(=CC=CC2=CC=CC=C2)C(=O)C(=CC=CC3=CC=CC=C3)C1

InChI

InChI=1S/C24H23NO/c1-25-18-22(16-8-14-20-10-4-2-5-11-20)24(26)23(19-25)17-9-15-21-12-6-3-7-13-21/h2-17H,18-19H2,1H3

InChIKey

UZMNXCUMVFUXQA-UHFFFAOYSA-N

Compound name

3,5-dicinnamylidene-1-methylpiperidin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 341.17798 Da
Monoisotopic Mass: 4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	342.185256	185.9
[M+Na]+	364.167198	190.9
[M-H]-	340.170704	192.7
[M+NH4]+	359.211803	197.4
[M+K]+	380.141138	181.9
[M+H-H2O]+	324.175240	175.4
[M+HCOO]-	386.176181	203.7
[M+CH3COO]-	400.191831	210.6
[M+Na-2H]-	362.152646	185.7
[M]+	341.17743142	180.5
[M]-	341.17852858	180.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.