CID 1097343

51921-68-7

Structural Information

Molecular Formula
C23H27N3O2
SMILES
CN(C)C1=CC=C(C=C1)/C=C(\C(=O)N2CCCCC2)/NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H27N3O2/c1-25(2)20-13-11-18(12-14-20)17-21(23(28)26-15-7-4-8-16-26)24-22(27)19-9-5-3-6-10-19/h3,5-6,9-14,17H,4,7-8,15-16H2,1-2H3,(H,24,27)/b21-17+
InChIKey
ALSDSRCOWVOSGV-HEHNFIMWSA-N
Compound name
N-[(E)-1-[4-(dimethylamino)phenyl]-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.21033 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.217606 192.6
[M+Na]+ 400.199548 192.7
[M-H]- 376.203054 200.2
[M+NH4]+ 395.244153 201.6
[M+K]+ 416.173488 189.0
[M+H-H2O]+ 360.207590 181.5
[M+HCOO]- 422.208531 210.1
[M+CH3COO]- 436.224181 225.4
[M+Na-2H]- 398.184996 191.7
[M]+ 377.20978142 187.2
[M]- 377.21087858 187.2
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.