CID 1097343

Brn 1664507

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]+ 378.21761 192.6
[M+Na]+ 400.19955 192.7
[M-H]- 376.20305 200.2
[M+NH4]+ 395.24415 201.6
[M+K]+ 416.17349 189.0
[M+H-H2O]+ 360.20759 181.5
[M+HCOO]- 422.20853 210.1
[M+CH3COO]- 436.22418 225.4
[M+Na-2H]- 398.18500 191.7
[M]+ 377.20978 187.2
[M]- 377.21088 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.