CID 3074075

155125-61-4

Structural Information

Molecular Formula
C19H28N2O
SMILES
CCC(=O)N(C1CCN(CC1C)CCC=C)C2=CC=CC=C2
InChI
InChI=1S/C19H28N2O/c1-4-6-13-20-14-12-18(16(3)15-20)21(19(22)5-2)17-10-8-7-9-11-17/h4,7-11,16,18H,1,5-6,12-15H2,2-3H3
InChIKey
GSHVJFJRMLMIJR-UHFFFAOYSA-N
Compound name
N-(1-but-3-enyl-3-methylpiperidin-4-yl)-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.22015 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.22743 176.3
[M+Na]+ 323.20937 187.2
[M+NH4]+ 318.25397 183.7
[M+K]+ 339.18331 179.6
[M-H]- 299.21287 180.3
[M+Na-2H]- 321.19482 182.1
[M]+ 300.21960 178.8
[M]- 300.22070 178.8
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.